N-[3-(4-methylpiperidin-1-yl)carbonyl-4-[4-(phenylmethyl)piperidin-1-yl]phenyl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[3-(4-methylpiperidin-1-yl)carbonyl-4-[4-(phenylmethyl)piperidin-1-yl]phenyl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[4-(4-benzyl-1-piperidyl)-3-(4-methylpiperidine-1-carbonyl)phenyl]-2-phenylsulfanyl-acetamide CAS Name: N-[3-[(4-methyl-1-piperidinyl)-oxomethyl]-4-[4-(phenylmethyl)-1-piperidinyl]phenyl]-2-(phenylthio)acetamide IUPAC Name: N-[4-(4-benzylpiperidin-1-yl)-3-(4-methylpiperidine-1-carbonyl)phenyl]-2-phenylsulfanylacetamide Traditional Name: N-[4-(4-benzylpiperidino)-3-(4-methylpiperidine-1-carbonyl)phenyl]-2-(phenylthio)acetamide Formula: C33H39N3O2S MolecularWeight: 541.74666

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C2=C(C=CC(=C2)NC(=O)CSC3=CC=CC=C3)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1CCN(CC1)C(=O)C2=C(C=CC(=C2)NC(=O)CSC3=CC=CC=C3)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C33H39N3O2S/c1-25-14-18-36(19-15-25)33(38)30-23-28(34-32(37)24-39-29-10-6-3-7-11-29)12-13-31(30)35-20-16-27(17-21-35)22-26-8-4-2-5-9-26/h2-13,23,25,27H,14-22,24H2,1H3,(H,34,37)