3-chloranyl-N-[3-[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]benzamide

Systemtic Name: 3-chloranyl-N-[3-[2-[(2,4-dimethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]benzamide Openeye Name: 3-chloro-N-[3-[2-(2,4-dimethoxyanilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]benzamide CAS Name: 3-chloro-N-[3-[[2-(2,4-dimethoxyanilino)-2-oxo-1-phenylethyl]thio]phenyl]benzamide IUPAC Name: 3-chloro-N-[3-[2-(2,4-dimethoxyanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]benzamide Traditional Name: 3-chloro-N-[3-[[2-(2,4-dimethoxyanilino)-2-keto-1-phenyl-ethyl]thio]phenyl]benzamide Formula: C29H25ClN2O4S MolecularWeight: 533.0378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)C4=CC(=CC=C4)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)SC3=CC=CC(=C3)NC(=O)C4=CC(=CC=C4)Cl)OC

InChI

InChI=1S/C29H25ClN2O4S/c1-35-23-14-15-25(26(18-23)36-2)32-29(34)27(19-8-4-3-5-9-19)37-24-13-7-12-22(17-24)31-28(33)20-10-6-11-21(30)16-20/h3-18,27H,1-2H3,(H,31,33)(H,32,34)