3-acetamido-N-[[1-[(2-ethoxyphenyl)methyl]piperidin-4-yl]methyl]-4-(4-methylphenyl)sulfanyl-benzamide

Systemtic Name: 3-acetamido-N-[[1-[(2-ethoxyphenyl)methyl]piperidin-4-yl]methyl]-4-(4-methylphenyl)sulfanyl-benzamide Openeye Name: 3-acetamido-N-[[1-[(2-ethoxyphenyl)methyl]-4-piperidyl]methyl]-4-(p-tolylsulfanyl)benzamide CAS Name: 3-acetamido-N-[[1-[(2-ethoxyphenyl)methyl]-4-piperidinyl]methyl]-4-[(4-methylphenyl)thio]benzamide IUPAC Name: 3-acetamido-N-[[1-[(2-ethoxyphenyl)methyl]piperidin-4-yl]methyl]-4-(4-methylphenyl)sulfanylbenzamide Traditional Name: 3-acetamido-N-[[1-(2-ethoxybenzyl)-4-piperidyl]methyl]-4-(p-tolylthio)benzamide Formula: C31H37N3O3S MolecularWeight: 531.70878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CN2CCC(CC2)CNC(=O)C3=CC(=C(C=C3)SC4=CC=C(C=C4)C)NC(=O)C

Isomeric SMILES

CCOC1=CC=CC=C1CN2CCC(CC2)CNC(=O)C3=CC(=C(C=C3)SC4=CC=C(C=C4)C)NC(=O)C

InChI

InChI=1S/C31H37N3O3S/c1-4-37-29-8-6-5-7-26(29)21-34-17-15-24(16-18-34)20-32-31(36)25-11-14-30(28(19-25)33-23(3)35)38-27-12-9-22(2)10-13-27/h5-14,19,24H,4,15-18,20-21H2,1-3H3,(H,32,36)(H,33,35)