AG00IBJE

65899-73-2 | 1-{2-[(2-chlorothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl}-1H-imidazole

AG00IBJE

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CAS Number	65899-73-2
Catalog Number	AG00IBJE(AGN-PC-0511N2)
Chemical Name	1-{2-[(2-chlorothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl}-1H-imidazole
EC Number	265-973-8
IUPAC Name	1-[2-[(2-chlorothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole
InChI	InChI=1S/C16H13Cl3N2OS/c17-12-1-2-13(14(18)7-12)15(8-21-5-4-20-10-21)22-9-11-3-6-23-16(11)19/h1-7,10,15H,8-9H2
InChI Key	QXHHHPZILQDDPS-UHFFFAOYSA-N
MDL Number	MFCD00057276
Molecular Formula	C16H13Cl3N2OS
Molecular Weight	387.7112
NSC Number	759169
SMILES	ClC1=CC=C(C(OCC2=C(Cl)SC=C2)CN3C=CN=C3)C(Cl)=C1
Synonyms	Gyno-Trosyd, Monistat 1-Day, Mykontral, tioconazole, Trosderm, Trosid, Trosyd, Trosyl, UK 20,349, Vagistat, Vagistat-1, tioconazole, 65899-73-2, Trosyl, Vagistat-1, Tioconazolum, Vagistat, Trosyd, Gyno-trosyd, Fungibacid, Tioconazol, Zoniden, Tioconazol [INN-Spanish], Tioconazolum [INN-Latin], Tz-3, UK-20349, C16H13Cl3N2OS, UK 20349, EINECS 265-973-8, BRN 0573867, CHEBI:77898, QXHHHPZILQDDPS-UHFFFAOYSA-N, 1-(2,4-Dichloro-beta-((2-chloro-3-thenyl)-oxy)phenethyl)imidazole, (+-)-1-(2,4-Dichloro-beta-((2-chloro-3-ethenyl)oxy)phenethyl)imidazole, MFCD00057276, NCGC00167430-01, 1-(2,4-Dichloro-(beta-(2-chloro-3-thenyl)oxy)phenethyl)imidazole, 1-[2-[(2-chlorothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole, DSSTox_CID_26619, DSSTox_RID_81771, DSSTox_GSID_46619, GyneCure, New Straitus, 1-[2-[(2-chloro-3-thienyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole, Trosyd J, Monistat 1, Trosyd AF, 1-(2-((2-chlorothiophen-3-yl)methoxy)-2-(2,4-dichlorophenyl)ethyl)-1H-imidazole, 1-[2-[(2-Chloro-3-thienyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]-1H-imidazole, 1H-Imidazole, 1-(2-((2-chloro-3-thienyl)methoxy)-2-(2,4-dichlorophenyl)ethyl)-, SMR001550005, (+-)-Tioconazole, CAS-65899-73-2, Vagistat-1 (TN), SR-05000001939, Tioconazole [USAN:BAN:INN:JAN], trosid, Thioconazole, Tioconazole (JAN/USP/INN), 1-{2-[(2-chloro-3-thienyl)methoxy]-2-(2,4-dichlorophenyl)ethyl}imidazole, 1-{2-[(2-chloro-3-thienyl)methoxy]-2-(2,4-dichlorophenyl)ethyl}-1H-imidazole, 1-{2-[(2-chlorothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl}-1H-imidazole, 1H-Imidazole, 1-[2-[(2-chloro-3-thienyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]-, Tioconazole, 97%, Tioconazole [USAN:USP:INN:BAN:JAN], UK 20,349, UK-20,349, (.+/-.)-Tioconazole, AC1L1KG2, SCHEMBL41354, 5-23-04-00324 (Beilstein Handbook Reference), MLS003899209, MLS004712040, MLS006010907, CHEMBL1200438, DTXSID3046619, CTK8G3486, HMS2090B12, HMS2093P11, HMS3655K22, HMS3712I10, Pharmakon1600-01505581, EBD39607, HY-B0319, KS-00001F6X, Tox21_112434, BDBM50370218, BG0341, DL-515, GA0099, KM0968, NSC759169, s1910, AKOS015906500, Tox21_112434_1, API0004425, CCG-213487, CS-2360, DB01007, KS-5114, NSC-759169, (+-)-1-[2-[(2-Chloro-3-thienyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]-1H-imidazole, NCGC00167430-02, NCGC00167430-03, NCGC00167430-04, AC-13425, AK546825, AN-38523, CC-35071, H949, LS-78340, SBI-0206824.P001, AB0013379, AB2000368, FT-0630756, SW198590-2, C08082, D00890, AB01275523-01, AB01275523_02, AB01275523_03, Tioconazole, VETRANAL(TM), analytical standard, 899T732, A835270, C-21484, SR-05000001939-1, SR-05000001939-2, BRD-A33084557-001-01-7, Tioconazole, United States Pharmacopeia (USP) Reference Standard, (+-)-1-(2 4-Dichloro-beta-((2-chloro-3-ethenyl)oxy)phenethyl)imidazole, 1-[2,4-Dichloro-.beta.-[(2-chloro-3-thenyl)-oxy]phenethyl]imidazole, (.+/-.)-1-(2,4-Dichloro-.beta.-((2-chloro-3-ethenyl)oxy)phenethyl)imidazole, 1-[(2S)-2-[(2-chlorothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole, 1-[2-[(2-chloranylthiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole, 1-[2-[(2-Chloro-3-thienyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]-1H-imidazole #, 1-[2-[(2-chloro-3-thiophenyl)methoxy]-2-(2,4-dichlorophenyl)ethyl]imidazole, 1-[2-[(2-chlorothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)-ethyl]imidazole, 1-[2-[(2-Chlorothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)-ethyl]imidazole; Vagistat, Tioconazole for system suitability, European Pharmacopoeia (EP) Reference Standard, null, D0CA6J, UNII-S57Y5X1117, CID5482, Tioconazole [USAN:INN:BAN:JAN], C16-H13-Cl3-N2-O-S, S57Y5X1117, 1-[2,4-dichloro-beta-[(2-chloro-3-thenyl)oxy]phenethyl]imidazole,

Complexity	379
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	385.981g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	387.703g/mol
Monoisotopic Mass	385.981g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	55.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	5.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number