2-acetamido-4-methylsulfanyl-N-[3-[4-[4-(2-oxidanylidene-3,4-dihydroquinolin-1-yl)piperidin-1-yl]carbonylphenoxy]propyl]butanamide

Systemtic Name: 2-acetamido-4-methylsulfanyl-N-[3-[4-[4-(2-oxidanylidene-3,4-dihydroquinolin-1-yl)piperidin-1-yl]carbonylphenoxy]propyl]butanamide Openeye Name: 2-acetamido-4-methylsulfanyl-N-[3-[4-[4-(2-oxo-3,4-dihydroquinolin-1-yl)piperidine-1-carbonyl]phenoxy]propyl]butanamide CAS Name: 2-acetamido-4-(methylthio)-N-[3-[4-[oxo-[4-(2-oxo-3,4-dihydroquinolin-1-yl)-1-piperidinyl]methyl]phenoxy]propyl]butanamide IUPAC Name: 2-acetamido-4-methylsulfanyl-N-[3-[4-[4-(2-oxo-3,4-dihydroquinolin-1-yl)piperidine-1-carbonyl]phenoxy]propyl]butanamide Traditional Name: 2-acetamido-N-[3-[4-[4-(2-keto-3,4-dihydroquinolin-1-yl)piperidine-1-carbonyl]phenoxy]propyl]-4-(methylthio)butyramide Formula: C31H40N4O5S MolecularWeight: 580.7381

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CCSC)C(=O)NCCCOC1=CC=C(C=C1)C(=O)N2CCC(CC2)N3C(=O)CCC4=CC=CC=C43

Isomeric SMILES

CC(=O)NC(CCSC)C(=O)NCCCOC1=CC=C(C=C1)C(=O)N2CCC(CC2)N3C(=O)CCC4=CC=CC=C43

InChI

InChI=1S/C31H40N4O5S/c1-22(36)33-27(16-21-41-2)30(38)32-17-5-20-40-26-11-8-24(9-12-26)31(39)34-18-14-25(15-19-34)35-28-7-4-3-6-23(28)10-13-29(35)37/h3-4,6-9,11-12,25,27H,5,10,13-21H2,1-2H3,(H,32,38)(H,33,36)