N-cyclohexyl-4-[1-(3,4,5-trimethoxyphenyl)carbonylpiperidin-4-yl]piperidine-1-carbothioamide

Systemtic Name: N-cyclohexyl-4-[1-(3,4,5-trimethoxyphenyl)carbonylpiperidin-4-yl]piperidine-1-carbothioamide Openeye Name: N-cyclohexyl-4-[1-(3,4,5-trimethoxybenzoyl)-4-piperidyl]piperidine-1-carbothioamide CAS Name: N-cyclohexyl-4-[1-[oxo-(3,4,5-trimethoxyphenyl)methyl]-4-piperidinyl]-1-piperidinecarbothioamide IUPAC Name: N-cyclohexyl-4-[1-(3,4,5-trimethoxybenzoyl)piperidin-4-yl]piperidine-1-carbothioamide Traditional Name: N-cyclohexyl-4-[1-(3,4,5-trimethoxybenzoyl)-4-piperidyl]piperidine-1-carbothioamide Formula: C27H41N3O4S MolecularWeight: 503.69714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(CC2)C3CCN(CC3)C(=S)NC4CCCCC4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(CC2)C3CCN(CC3)C(=S)NC4CCCCC4

InChI

InChI=1S/C27H41N3O4S/c1-32-23-17-21(18-24(33-2)25(23)34-3)26(31)29-13-9-19(10-14-29)20-11-15-30(16-12-20)27(35)28-22-7-5-4-6-8-22/h17-20,22H,4-16H2,1-3H3,(H,28,35)