N-[3-[1-oxidanylidene-1-[(4-phenoxyphenyl)amino]propan-2-yl]sulfanylphenyl]pentanamide

Systemtic Name: N-[3-[1-oxidanylidene-1-[(4-phenoxyphenyl)amino]propan-2-yl]sulfanylphenyl]pentanamide Openeye Name: N-[3-[1-methyl-2-oxo-2-(4-phenoxyanilino)ethyl]sulfanylphenyl]pentanamide CAS Name: N-[3-[[1-oxo-1-(4-phenoxyanilino)propan-2-yl]thio]phenyl]pentanamide IUPAC Name: N-[3-[1-oxo-1-(4-phenoxyanilino)propan-2-yl]sulfanylphenyl]pentanamide Traditional Name: N-[3-[[2-keto-1-methyl-2-(4-phenoxyanilino)ethyl]thio]phenyl]valeramide Formula: C26H28N2O3S MolecularWeight: 448.57712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC(=CC=C1)SC(C)C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

CCCCC(=O)NC1=CC(=CC=C1)SC(C)C(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C26H28N2O3S/c1-3-4-13-25(29)27-21-9-8-12-24(18-21)32-19(2)26(30)28-20-14-16-23(17-15-20)31-22-10-6-5-7-11-22/h5-12,14-19H,3-4,13H2,1-2H3,(H,27,29)(H,28,30)