N-[4-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]-3,4-dimethoxy-benzamide

Systemtic Name: N-[4-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanylphenyl]-3,4-dimethoxy-benzamide Openeye Name: N-[4-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanylphenyl]-3,4-dimethoxy-benzamide CAS Name: N-[4-[[2-(4-chlorophenyl)-2-oxoethyl]thio]phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[4-[2-(4-chlorophenyl)-2-oxoethyl]sulfanylphenyl]-3,4-dimethoxybenzamide Traditional Name: N-[4-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]phenyl]-3,4-dimethoxy-benzamide Formula: C23H20ClNO4S MolecularWeight: 441.9272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)SCC(=O)C3=CC=C(C=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)SCC(=O)C3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C23H20ClNO4S/c1-28-21-12-5-16(13-22(21)29-2)23(27)25-18-8-10-19(11-9-18)30-14-20(26)15-3-6-17(24)7-4-15/h3-13H,14H2,1-2H3,(H,25,27)