N-[[4-(2-methylpropanoylamino)phenyl]methyl]-4-phenylsulfanyl-butanamide

Systemtic Name: N-[[4-(2-methylpropanoylamino)phenyl]methyl]-4-phenylsulfanyl-butanamide Openeye Name: N-[[4-(2-methylpropanoylamino)phenyl]methyl]-4-phenylsulfanyl-butanamide CAS Name: N-[[4-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-4-(phenylthio)butanamide IUPAC Name: N-[[4-(2-methylpropanoylamino)phenyl]methyl]-4-phenylsulfanylbutanamide Traditional Name: N-[4-(isobutyrylamino)benzyl]-4-(phenylthio)butyramide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)CNC(=O)CCCSC2=CC=CC=C2

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)CNC(=O)CCCSC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O2S/c1-16(2)21(25)23-18-12-10-17(11-13-18)15-22-20(24)9-6-14-26-19-7-4-3-5-8-19/h3-5,7-8,10-13,16H,6,9,14-15H2,1-2H3,(H,22,24)(H,23,25)