N-(4-methylphenyl)-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-butanamide

Systemtic Name: N-(4-methylphenyl)-2-[3-(2-phenylethanoylamino)phenyl]sulfanyl-butanamide Openeye Name: 2-[3-[(2-phenylacetyl)amino]phenyl]sulfanyl-N-(p-tolyl)butanamide CAS Name: N-(4-methylphenyl)-2-[[3-[(1-oxo-2-phenylethyl)amino]phenyl]thio]butanamide IUPAC Name: N-(4-methylphenyl)-2-[3-[(2-phenylacetyl)amino]phenyl]sulfanylbutanamide Traditional Name: 2-[[3-[(2-phenylacetyl)amino]phenyl]thio]-N-(p-tolyl)butyramide Formula: C25H26N2O2S MolecularWeight: 418.55114

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C)SC2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)C)SC2=CC=CC(=C2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C25H26N2O2S/c1-3-23(25(29)27-20-14-12-18(2)13-15-20)30-22-11-7-10-21(17-22)26-24(28)16-19-8-5-4-6-9-19/h4-15,17,23H,3,16H2,1-2H3,(H,26,28)(H,27,29)