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

Systemtic Name: N-[3-[1-[(4-ethanoylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]pentanamide Openeye Name: N-[3-[2-(4-acetylanilino)-1-methyl-2-oxo-ethyl]sulfanylphenyl]pentanamide CAS Name: N-[3-[[1-(4-acetylanilino)-1-oxopropan-2-yl]thio]phenyl]pentanamide IUPAC Name: N-[3-[1-(4-acetylanilino)-1-oxopropan-2-yl]sulfanylphenyl]pentanamide Traditional Name: N-[3-[[2-(4-acetylanilino)-2-keto-1-methyl-ethyl]thio]phenyl]valeramide Formula: C22H26N2O3S MolecularWeight: 398.51844

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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)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O3S/c1-4-5-9-21(26)23-19-7-6-8-20(14-19)28-16(3)22(27)24-18-12-10-17(11-13-18)15(2)25/h6-8,10-14,16H,4-5,9H2,1-3H3,(H,23,26)(H,24,27)