4-[oxidanyl(diphenyl)methyl]-N-(3,4,5-trimethoxyphenyl)piperidine-1-carbothioamide

Systemtic Name: 4-[oxidanyl(diphenyl)methyl]-N-(3,4,5-trimethoxyphenyl)piperidine-1-carbothioamide Openeye Name: 4-[hydroxy(diphenyl)methyl]-N-(3,4,5-trimethoxyphenyl)piperidine-1-carbothioamide CAS Name: 4-[hydroxy(diphenyl)methyl]-N-(3,4,5-trimethoxyphenyl)-1-piperidinecarbothioamide IUPAC Name: 4-[hydroxy(diphenyl)methyl]-N-(3,4,5-trimethoxyphenyl)piperidine-1-carbothioamide Traditional Name: 4-[hydroxy(diphenyl)methyl]-N-(3,4,5-trimethoxyphenyl)piperidine-1-carbothioamide Formula: C28H32N2O4S MolecularWeight: 492.62968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=S)N2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=S)N2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

InChI

InChI=1S/C28H32N2O4S/c1-32-24-18-23(19-25(33-2)26(24)34-3)29-27(35)30-16-14-22(15-17-30)28(31,20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-13,18-19,22,31H,14-17H2,1-3H3,(H,29,35)