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

Systemtic Name: 3-acetamido-4-(4-methylphenyl)sulfanyl-N-[2-[4-(phenylmethyl)piperidin-1-yl]ethyl]benzamide Openeye Name: 3-acetamido-N-[2-(4-benzyl-1-piperidyl)ethyl]-4-(p-tolylsulfanyl)benzamide CAS Name: 3-acetamido-4-[(4-methylphenyl)thio]-N-[2-[4-(phenylmethyl)-1-piperidinyl]ethyl]benzamide IUPAC Name: 3-acetamido-N-[2-(4-benzylpiperidin-1-yl)ethyl]-4-(4-methylphenyl)sulfanylbenzamide Traditional Name: 3-acetamido-N-[2-(4-benzylpiperidino)ethyl]-4-(p-tolylthio)benzamide Formula: C30H35N3O2S MolecularWeight: 501.6828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NCCN3CCC(CC3)CC4=CC=CC=C4)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NCCN3CCC(CC3)CC4=CC=CC=C4)NC(=O)C

InChI

InChI=1S/C30H35N3O2S/c1-22-8-11-27(12-9-22)36-29-13-10-26(21-28(29)32-23(2)34)30(35)31-16-19-33-17-14-25(15-18-33)20-24-6-4-3-5-7-24/h3-13,21,25H,14-20H2,1-2H3,(H,31,35)(H,32,34)