N-[4-[2-[(3-methylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]pentanamide

Systemtic Name: N-[4-[2-[(3-methylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]pentanamide Openeye Name: N-[4-[2-(3-methylanilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]pentanamide CAS Name: N-[4-[[2-(3-methylanilino)-2-oxo-1-phenylethyl]thio]phenyl]pentanamide IUPAC Name: N-[4-[2-(3-methylanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]pentanamide Traditional Name: N-[4-[[2-keto-2-(m-toluidino)-1-phenyl-ethyl]thio]phenyl]valeramide Formula: C26H28N2O2S MolecularWeight: 432.57772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)SC(C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)SC(C2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C26H28N2O2S/c1-3-4-13-24(29)27-21-14-16-23(17-15-21)31-25(20-10-6-5-7-11-20)26(30)28-22-12-8-9-19(2)18-22/h5-12,14-18,25H,3-4,13H2,1-2H3,(H,27,29)(H,28,30)