O-methyl 4-(4-chlorophenyl)-4-oxidanylidene-3-(1H-thieno[2,3-d]imidazol-2-yl)butanethioate

Systemtic Name: O-methyl 4-(4-chlorophenyl)-4-oxidanylidene-3-(1H-thieno[2,3-d]imidazol-2-yl)butanethioate Openeye Name: O-methyl 4-(4-chlorophenyl)-4-oxo-3-(1H-thieno[2,3-d]imidazol-2-yl)butanethioate CAS Name: 4-(4-chlorophenyl)-4-oxo-3-(1H-thieno[2,3-d]imidazol-2-yl)butanethioic acid O-methyl ester IUPAC Name: O-methyl 4-(4-chlorophenyl)-4-oxo-3-(1H-thieno[2,3-d]imidazol-2-yl)butanethioate Traditional Name: 4-(4-chlorophenyl)-4-keto-3-(1H-thien[2,3-d]imidazol-2-yl)butanethioic acid O-methyl ester Formula: C16H13ClN2O2S2 MolecularWeight: 364.86962

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Descriptors Computed from Structure

Canonical SMILES:

COC(=S)CC(C1=NC2=C(N1)C=CS2)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=S)CC(C1=NC2=C(N1)C=CS2)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN2O2S2/c1-21-13(22)8-11(14(20)9-2-4-10(17)5-3-9)15-18-12-6-7-23-16(12)19-15/h2-7,11H,8H2,1H3,(H,18,19)