N-(4-methylsulfanylphenyl)-4-[1-(3,4,5-trimethoxyphenyl)carbonylpiperidin-4-yl]piperidine-1-carboxamide

Systemtic Name: N-(4-methylsulfanylphenyl)-4-[1-(3,4,5-trimethoxyphenyl)carbonylpiperidin-4-yl]piperidine-1-carboxamide Openeye Name: N-(4-methylsulfanylphenyl)-4-[1-(3,4,5-trimethoxybenzoyl)-4-piperidyl]piperidine-1-carboxamide CAS Name: N-[4-(methylthio)phenyl]-4-[1-[oxo-(3,4,5-trimethoxyphenyl)methyl]-4-piperidinyl]-1-piperidinecarboxamide IUPAC Name: N-(4-methylsulfanylphenyl)-4-[1-(3,4,5-trimethoxybenzoyl)piperidin-4-yl]piperidine-1-carboxamide Traditional Name: N-[4-(methylthio)phenyl]-4-[1-(3,4,5-trimethoxybenzoyl)-4-piperidyl]piperidine-1-carboxamide Formula: C28H37N3O5S MolecularWeight: 527.67548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(CC2)C3CCN(CC3)C(=O)NC4=CC=C(C=C4)SC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(CC2)C3CCN(CC3)C(=O)NC4=CC=C(C=C4)SC

InChI

InChI=1S/C28H37N3O5S/c1-34-24-17-21(18-25(35-2)26(24)36-3)27(32)30-13-9-19(10-14-30)20-11-15-31(16-12-20)28(33)29-22-5-7-23(37-4)8-6-22/h5-8,17-20H,9-16H2,1-4H3,(H,29,33)