3,4-dimethoxy-N-[3-(2-oxidanylidene-1-phenyl-2-phenylazanyl-ethyl)sulfanylphenyl]benzamide

Systemtic Name: 3,4-dimethoxy-N-[3-(2-oxidanylidene-1-phenyl-2-phenylazanyl-ethyl)sulfanylphenyl]benzamide Openeye Name: N-[3-(2-anilino-2-oxo-1-phenyl-ethyl)sulfanylphenyl]-3,4-dimethoxy-benzamide CAS Name: N-[3-[(2-anilino-2-oxo-1-phenylethyl)thio]phenyl]-3,4-dimethoxybenzamide IUPAC Name: N-[3-(2-anilino-2-oxo-1-phenylethyl)sulfanylphenyl]-3,4-dimethoxybenzamide Traditional Name: N-[3-[(2-anilino-2-keto-1-phenyl-ethyl)thio]phenyl]-3,4-dimethoxy-benzamide Formula: C29H26N2O4S MolecularWeight: 498.59274

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC=CC=C4)OC

InChI

InChI=1S/C29H26N2O4S/c1-34-25-17-16-21(18-26(25)35-2)28(32)31-23-14-9-15-24(19-23)36-27(20-10-5-3-6-11-20)29(33)30-22-12-7-4-8-13-22/h3-19,27H,1-2H3,(H,30,33)(H,31,32)