AG0073NW

130693-82-2 | Dorzolomide hydrochloride

AG0073NW

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CAS Number	130693-82-2
Catalog Number	AG0073NW(AGN-PC-0PJABY)
Chemical Name	Dorzolomide hydrochloride
IUPAC Name	(4S,6S)-4-(ethylamino)-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide;hydrochloride
InChI	InChI=1S/C10H16N2O4S3.ClH/c1-3-12-8-4-6(2)18(13,14)10-7(8)5-9(17-10)19(11,15)16;/h5-6,8,12H,3-4H2,1-2H3,(H2,11,15,16);1H/t6-,8-;/m0./s1
InChI Key	OSRUSFPMRGDLAG-QMGYSKNISA-N
MDL Number	MFCD00884659
Molecular Formula	C10H17ClN2O4S3
Molecular Weight	360.9010
SMILES	Cl.C(C)N[C@@H]1C2=C(S([C@H](C1)C)(=O)=O)SC(=C2)S(=O)(=O)N
UNII	QZO5366EW7
Synonyms	4-ethylamino-5,6-dihydro-6-methyl-7,7-dioxide-4H-thieno(2,3-b)thiopyran-2-sulfonamide, 5,6-dihydro-4-ethylamino-6-methyl-4H-thieno(2,3-b)thiopyran-2-sulfonamide-7,7-dioxide, dorzolamide, Dorzolamide Chibret, dorzolamide hydrochloride, dorzolamide, (trans)-isomer, L 671152, L-671,152, MK 507, MK-507, Trusopt, DORZOLAMIDE HYDROCHLORIDE, Dorzolamide HCl, 130693-82-2, Trusopt, Dorzolomide hydrochloride, Cosopt, Dorzolamide (hydrochloride), UNII-QZO5366EW7, QZO5366EW7, MK-507, Trusopt (TN), DSSTox_CID_25530, DSSTox_RID_80933, DSSTox_GSID_45530, L 671152, L-671,152, C10H16N2O4S3.HCl, CHEBI:4703, MK 0507, MK-0507, (4S,6S)-4-(ethylamino)-6-methyl-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide 7,7-dioxide hydrochloride, (4S,6S)-4-(ethylamino)-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide hydrochloride, Dorzolamide impurity A, SR-05000001449, Dorzolamide-HCL, (4S,6S)-4-(Ethylamino)-5,6-dihydro-6-methyl-4H-thieno(2,3-b)thiopyran-2-sulfonamide 7,7-dioxide, monohydrochloride, (4S,6S)-4-(ethylamino)-6-methyl-7,7-dioxo-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide;hydrochloride, Dorzolamide HCl salt, Dorzolamide hydrochloride [USAN:USP], L671152 hydrochloride, NCGC00016977-01, AC1OCF25, CAS-130693-82-2, SCHEMBL41152, MLS002154162, CHEMBL1201162, DTXSID1045530, CTK8E7974, HY-B0109A, KS-00000XJI, OSRUSFPMRGDLAG-QMGYSKNISA-N, HMS1571O14, 4H-Thieno(2,3-b)thiopyran-2-sulfonamide, 4-(ethylamino)-5,6-dihydro-6-methyl-, 7,7-dioxide, monohydrochloride, (4S-trans)-, 4H-Thieno(2,3-b)thiopyran-2-sulfonamide, 5,6-dihydro-4-(ethylamino)-6-methyl-, 7,7-dioxide, monohydrochloride, (4S,6S)-, Tox21_110720, ABP001060, MFCD00884659, s1375, AKOS005146235, AKOS015895951, Dorzolamide hydrochloride (JP17/USP), Tox21_110720_1, AC-5244, API0007146, CCG-221116, CS-1858, KS-1348, RTC-070963, NCGC00179244-03, BC208520, CC-27373, SC-18010, SMR001233461, MK-507 (L-671152) HCl, TC-070963, D4189, FT-0082547, FT-0631133, D00653, J10249, K-4065, 279D961, I06-1271, L-671152, SR-05000001449-3, Dorzolamide hydrochloride, European Pharmacopoeia (EP) Reference Standard, Dorzolamide for system suitability, European Pharmacopoeia (EP) Reference Standard, Dorzolamide hydrochloride, United States Pharmacopeia (USP) Reference Standard, (4S,6S)-4-(ethylamino)-5,6-dihydro-6-methyl-, 7,7-dioxide 4H-Thieno[2,3-b]thiopyran-2-sulfonamide hydrochloride, dorzolamide, Dorzolamide Chibret, dorzolamide, (trans)-isomer, C10H16N2O4S3.ClH, Dorzolamide hydrochloride [USAN], MK 507, ACN-031792, CID6918132, C10-H16-N2-O4-S3.Cl-H, A4357, C062765, 120279-96-1, 4-ethylamino-5,6-dihydro-6-methyl-7,7-dioxide-4H-thieno(2,3-b)thiopyran-2-sulfonamide, 5,6-dihydro-4-ethylamino-6-methyl-4H-thieno(2,3-b)thiopyran-2-sulfonamide-7,7-dioxide,

Complexity	534
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	360.004g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	360.886g/mol
Monoisotopic Mass	360.004g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	151A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P264-P270-P301+P312+P330-P501
UN Code

Certificate of Analysis

Lot Number