2-[4-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-(2-phenylsulfanylphenyl)propanamide

Systemtic Name: 2-[4-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-(2-phenylsulfanylphenyl)propanamide Openeye Name: 2-[4-[2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl]piperazin-1-yl]-N-(2-phenylsulfanylphenyl)propanamide CAS Name: 2-[4-[2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl]-1-piperazinyl]-N-[2-(phenylthio)phenyl]propanamide IUPAC Name: 2-[4-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl]-N-(2-phenylsulfanylphenyl)propanamide Traditional Name: 2-[4-[2-(3,5-dimethylpiperidino)-2-keto-ethyl]piperazino]-N-[2-(phenylthio)phenyl]propionamide Formula: C28H38N4O2S MolecularWeight: 494.69192

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CN2CCN(CC2)C(C)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CN2CCN(CC2)C(C)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4)C

InChI

InChI=1S/C28H38N4O2S/c1-21-17-22(2)19-32(18-21)27(33)20-30-13-15-31(16-14-30)23(3)28(34)29-25-11-7-8-12-26(25)35-24-9-5-4-6-10-24/h4-12,21-23H,13-20H2,1-3H3,(H,29,34)