1-[(3S)-3-[(3,4-dimethoxyphenyl)amino]piperidin-1-yl]-2-methylsulfanyl-ethanone

Systemtic Name: 1-[(3S)-3-[(3,4-dimethoxyphenyl)amino]piperidin-1-yl]-2-methylsulfanyl-ethanone Openeye Name: 1-[(3S)-3-(3,4-dimethoxyanilino)-1-piperidyl]-2-methylsulfanyl-ethanone CAS Name: 1-[(3S)-3-(3,4-dimethoxyanilino)-1-piperidinyl]-2-(methylthio)ethanone IUPAC Name: 1-[(3S)-3-(3,4-dimethoxyanilino)piperidin-1-yl]-2-methylsulfanylethanone Traditional Name: 1-[(3S)-3-(3,4-dimethoxyanilino)piperidino]-2-(methylthio)ethanone Formula: C16H24N2O3S MolecularWeight: 324.43836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2CCCN(C2)C(=O)CSC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N[C@H]2CCCN(C2)C(=O)CSC)OC

InChI

InChI=1S/C16H24N2O3S/c1-20-14-7-6-12(9-15(14)21-2)17-13-5-4-8-18(10-13)16(19)11-22-3/h6-7,9,13,17H,4-5,8,10-11H2,1-3H3/t13-/m0/s1