S-[1-(4-chlorophenyl)-2-imidazol-1-yl-ethyl] 3,4-bis(chloranyl)benzenecarbothioate

Systemtic Name: S-[1-(4-chlorophenyl)-2-imidazol-1-yl-ethyl] 3,4-bis(chloranyl)benzenecarbothioate Openeye Name: S-[1-(4-chlorophenyl)-2-imidazol-1-yl-ethyl] 3,4-dichlorobenzenecarbothioate CAS Name: 3,4-dichlorobenzenecarbothioic acid S-[1-(4-chlorophenyl)-2-(1-imidazolyl)ethyl] ester IUPAC Name: S-[1-(4-chlorophenyl)-2-imidazol-1-ylethyl] 3,4-dichlorobenzenecarbothioate Traditional Name: 3,4-dichlorothiobenzoic acid S-[1-(4-chlorophenyl)-2-imidazol-1-yl-ethyl] ester Formula: C18H13Cl3N2OS MolecularWeight: 411.73262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CN2C=CN=C2)SC(=O)C3=CC(=C(C=C3)Cl)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C(CN2C=CN=C2)SC(=O)C3=CC(=C(C=C3)Cl)Cl)Cl

InChI

InChI=1S/C18H13Cl3N2OS/c19-14-4-1-12(2-5-14)17(10-23-8-7-22-11-23)25-18(24)13-3-6-15(20)16(21)9-13/h1-9,11,17H,10H2