N-(furan-2-ylmethyl)-4-[1-(3,4,5-trimethoxyphenyl)carbonylpiperidin-4-yl]piperidine-1-carbothioamide

Systemtic Name: N-(furan-2-ylmethyl)-4-[1-(3,4,5-trimethoxyphenyl)carbonylpiperidin-4-yl]piperidine-1-carbothioamide Openeye Name: N-(2-furylmethyl)-4-[1-(3,4,5-trimethoxybenzoyl)-4-piperidyl]piperidine-1-carbothioamide CAS Name: N-(2-furanylmethyl)-4-[1-[oxo-(3,4,5-trimethoxyphenyl)methyl]-4-piperidinyl]-1-piperidinecarbothioamide IUPAC Name: N-(furan-2-ylmethyl)-4-[1-(3,4,5-trimethoxybenzoyl)piperidin-4-yl]piperidine-1-carbothioamide Traditional Name: N-(2-furfuryl)-4-[1-(3,4,5-trimethoxybenzoyl)-4-piperidyl]piperidine-1-carbothioamide Formula: C26H35N3O5S MolecularWeight: 501.6382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(CC2)C3CCN(CC3)C(=S)NCC4=CC=CO4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(CC2)C3CCN(CC3)C(=S)NCC4=CC=CO4

InChI

InChI=1S/C26H35N3O5S/c1-31-22-15-20(16-23(32-2)24(22)33-3)25(30)28-10-6-18(7-11-28)19-8-12-29(13-9-19)26(35)27-17-21-5-4-14-34-21/h4-5,14-16,18-19H,6-13,17H2,1-3H3,(H,27,35)