AG003V0G

133-67-5 | 6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide

AG003V0G

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CAS Number	133-67-5
Catalog Number	AG003V0G(AGN-PC-0PK1UM)
Chemical Name	6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide
EC Number	205-118-8
IUPAC Name	6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide
InChI	InChI=1S/C8H8Cl3N3O4S2/c9-3-1-4-6(2-5(3)19(12,15)16)20(17,18)14-8(13-4)7(10)11/h1-2,7-8,13-14H,(H2,12,15,16)
InChI Key	LMJSLTNSBFUCMU-UHFFFAOYSA-N
MDL Number	MFCD00057315
Molecular Formula	C8H8Cl3N3O4S2
Molecular Weight	380.6558
SMILES	O=S(C1=C(Cl)C=C(C2=C1)NC(C(Cl)Cl)NS2(=O)=O)(N)=O
Synonyms	Aquazide, Naqua, Triazide, Trichlormethiazide, Trichloromethiazide, trichlormethiazide, Trichloromethiazide, 133-67-5, Naqua, Trichlormetazid, Metahydrin, Achletin, Trichlormethiazid, Diu-Hydrin, Chlopolidine, Hydrotrichlorothiazide, Aponorin, Cretonin, Diurazida, Diuroral, Fluitran, Gangesol, Intromene, Isestran, Schebitran, Triflumen, Diurese, Esmarin, Flurese, Flutra, Nakva, Triclordiuride, Anistadin, Carvacron, Kubacron, Tachionin, Tolcasone, Trichlorex, Eurinol, Triclormetiazide, Trichloromethiadiazide, Metatensin, Trichlormas, Trichlordiuride, Triclormetiazida, Ciba 7057-Su, Salurin (wadel), Trichlormethiazidum, Flurese (VAN), Naquasone, Triclormetiazide [DCIT], Triclormetiazide [Italian], 3-Dichloromethylhydrochlorothiazide, 2H-1,2,4-Benzothiadiazine-7-sulfonamide, 6-chloro-3-(dichloromethyl)-3,4-dihydro-, 1,1-dioxide, Trichlormethiazidum [INN-Latin], NSC 61560, Trichlormethiazide W/ Reserpine, Triclormetiazida [INN-Spanish], HSDB 3406, 3-Dichloromethyl-6-chloro-7-sulfamyl-3,4-dihydro-1,2,4-benzothiadiazine 1,1-dioxide, EINECS 205-118-8, BRN 0629145, 3-Dichloromethyl-6-chloro-7-sulfamoyl-3,4-dihydro-1,2,4-benzothiadiazine-1,1-dioxide, 6-Chloro-3-(dichloromethyl)3,4-dihydro-7-sulfamyl-1,2,4-benzothiadiazine-1,1-dioxide, MLS000028705, CHEBI:9683, 3-Dichloromethyl-6-chloro-7-sulfamyl-3,4-dihydro-1,2,4-benzothiadiazine1,1-dioxide, 6-Chloro-3-dichloromethyl-7-sulfamyl-3,4-dihydro-1,2,4-benzothiadiazine1,1-dioxide, 6-Chloro-3-(dichloromethyl)-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide, SMR000058712, DSSTox_CID_3699, 3-(Dichloromethyl)-6-chloro-7-sulfamoyl-3,4-dihydro-1,2,4-benzothiadiazine 1,1-dioxide, 6-Chloro-3-[dichloromethyl]-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide-1,1-dioxide, 6-Chloro-3-dichloromethyl-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-Dioxide, DSSTox_RID_77154, DSSTox_GSID_23699, (+-)-6-Chloro-3-(dichloromethyl)-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide, 6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide, Q-201860, 2H-1,2,4-Benzothiadiazine-7-sulfonamide, 6-chloro-3-(dichloromethyl)-3,4-dihydro-, 1,1-dioxide, (+-)-, 6-chloro-3-(dichloromethyl)-3,4-dihydro-2H-benzo[e][1,2,4]thiadiazine-7-sulfonamide 1,1-dioxide, Trichlormethiazide [INN:JAN], Naqua (TN), trichloromethiazide, 6, SR-01000000284, NCGC00016398-01, Trichlormethiazide [USP:INN:JAN], 6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-2H-1?^{6},2,4-benzothiadiazine-7-sulfonamide, CAS-133-67-5, Prestwick_1020, Spectrum_000520, AC1L1KMB, Opera_ID_1588, Prestwick0_000825, Prestwick1_000825, Prestwick2_000825, Prestwick3_000825, Spectrum2_000948, Spectrum3_001373, Spectrum4_000367, Spectrum5_001074, AC1Q6TQ0, CHEMBL1054, NCIOpen2_007750, Trichlormethiazide, >=98%, SCHEMBL25492, BSPBio_000749, BSPBio_002926, KBioGR_000833, KBioSS_001000, Trichlormethiazide (Achletin), Achletin;Diu-Hydrin;Triflumen, MLS001076545, DivK1c_000366, SPECTRUM1500590, SPBio_000916, SPBio_002670, BPBio1_000825, GTPL7314, DTXSID7023699, BDBM26998, CTK8B3334, HMS501C08, KBio1_000366, KBio2_001000, KBio2_003568, KBio2_006136, KBio3_002146, LMJSLTNSBFUCMU-UHFFFAOYSA-N, NINDS_000366, HMS1570F11, HMS1921G13, HMS2090G08, HMS2092O19, HMS2097F11, HMS2235K21, HMS3371B09, HMS3655I17, HMS3714F11, Pharmakon1600-01500590, HY-B0235, NSC61560, Tox21_110421, 2764AH, ANW-42313, MFCD00057315, NSC-61560, NSC757368, s1667, Trichlormethiazide (JP17/USP/INN), AKOS024374993, Tox21_110421_1, API0008988, CCG-212834, CS-2203, DB01021, MCULE-5170594512, NSC-757368, 6-Chloro-3-(dichloromethyl)3,4-dihydro-7-sulfamoyl-1,2,4-benzothiadiazine-1,1-dioxide, IDI1_000366, NCGC00018302-02, NCGC00018302-03, NCGC00018302-04, NCGC00018302-07, NCGC00018302-08, NCGC00089756-02, NCGC00089756-03, 2H-1,2,4-Benzothiadiazine-7-sulfonamide, 6-chloro-3-(dichloromethyl)-3,4-dihydro-,1,1-dioxide, AK546522, AN-43719, LS-40435, SC-80012, SBI-0051544.P002, AB2000205, TR-004572, WLN: T66 BSWM EM DHJ DYGG HG ISZW, AB00052117, FT-0746865, ST51015129, SW197095-3, C07767, D00658, 54260-EP2269989A1, 54260-EP2272832A1, 54260-EP2308562A2, 66946-EP2295406A1, 66946-EP2298772A1, 66946-EP2298776A1, 66946-EP2308839A1, AB00052117-15, AB00052117_16, AB00052117_17, C-44332, SR-01000000284-2, SR-01000000284-4, BRD-A28940325-001-05-9, BRD-A28940325-001-15-8, I14-107329, 6-Chloro-3-(dichloromethyl)3,2,4-benzothiadiazine-1,1-dioxide, Trichlormethiazide, United States Pharmacopeia (USP) Reference Standard, 2h-1,2,4-benzothiadiazine-7-sulfonamide,6-chloro-3-(dichloromethyl)-3,4-dihydr, 3-(dichloromethyl)-6-chloro-1,1-dioxo-2H,3H,4H-benzo[e]1,2,4-thiadiazine-7-sul fonamide, 3-(Dichloromethyl)-6-chloro-7-sulfamoyl-3,2,4-benzothiadiazine 1,1-dioxide, 3-(Dichloromethyl)-6-chloro-7-sulfamoyl-3,2,4-benzothiadiazine-1,1-dioxide, 3-dichloromethyl-6-chloro-7-sulfamoyl-3,4-dihydro-1,2,4-benzothiadiazine-1,1, 6-Chloro-3-(dichloromethyl)-3,2,4-benzothiadiazine-7-sulfonamide1,1-dioxide, 6-Chloro-3-(dichloromethyl)-3,4-dihydro-2H-1,2,4-thiadiazine-7-sulfonamide 1,1-dioxide, 2H-1,4-Benzothiadiazine-7-sulfonamide, 6-chloro-3-(dichloromethyl)-3,4-dihydro-, 1,1-dioxide, 6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-2H-1$l;{6},2,4-benzothiadiazine-7-sulfonamide, 6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-7-sulfonamide, Anatran, Aquazide, Naquival, Triazide, Salurin, Mixture Name, Metatensin #2, Metatensin #4, Triflumen (TN), Achletin (TN), Diu-Hydrin (TN), Naquasone (Veterinary), component of Naquival, component of Metatensin, C8H8Cl3N3O4S2, UNII-Q58C92TUN0, D0Y2IZ, Triclormetiazida[INN-Spanish], Q58C92TUN0, CID5560, Jones Brand of Trichloromethiazide, Schering Brand of Trichlormethiazide, C8-H8-Cl3-N3-O4-S2, AR-1H7280, Trichlormethiazide (JP15/USP/INN), T1318, American Urologicals Brand of Trichloromethiazide, D014237, 6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-2H-1, 3-(Dichloromethyl)-6-chloro-7-sulfamoyl-3,4-dihydro-1,2,4-benzothiadiazine-1,1-dioxide, 6-Chloro-3-(dichloromethyl)-3,4-dihydro-7-sulfamyl-1,2,4-benzothiadiazine-1,1-dioxide, 6-chloro-3-dichloromethyl-7-sulfamyl-3,4-dihydro-1,2,4-benzothiadiazine 1,1-dioxide, 4199-09-1, 6-Chloro-3-(dichloromethyl)-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide1,1-dioxide,

Complexity	571
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	378.902g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	380.639g/mol
Monoisotopic Mass	378.902g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	135A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H317-H334
Packing Group	Ⅲ
Precautionary statements	P261-P280-P342+P311
UN Code	UN 2811

Certificate of Analysis

Lot Number