N-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]pentanamide

Systemtic Name: N-[4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]pentanamide Openeye Name: N-[4-[2-(2,6-dimethylanilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]pentanamide CAS Name: N-[4-[[2-(2,6-dimethylanilino)-2-oxo-1-phenylethyl]thio]phenyl]pentanamide IUPAC Name: N-[4-[2-(2,6-dimethylanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]pentanamide Traditional Name: N-[4-[[2-(2,6-dimethylanilino)-2-keto-1-phenyl-ethyl]thio]phenyl]valeramide Formula: C27H30N2O2S MolecularWeight: 446.6043

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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=C(C=CC=C3C)C

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)SC(C2=CC=CC=C2)C(=O)NC3=C(C=CC=C3C)C

InChI

InChI=1S/C27H30N2O2S/c1-4-5-14-24(30)28-22-15-17-23(18-16-22)32-26(21-12-7-6-8-13-21)27(31)29-25-19(2)10-9-11-20(25)3/h6-13,15-18,26H,4-5,14H2,1-3H3,(H,28,30)(H,29,31)