4-piperidin-1-yl-1-[(3,4,5-trimethoxyphenyl)carbamothioyl]piperidine-4-carboxamide

Systemtic Name: 4-piperidin-1-yl-1-[(3,4,5-trimethoxyphenyl)carbamothioyl]piperidine-4-carboxamide Openeye Name: 4-(1-piperidyl)-1-[(3,4,5-trimethoxyphenyl)carbamothioyl]piperidine-4-carboxamide CAS Name: 4-(1-piperidinyl)-1-[sulfanylidene-(3,4,5-trimethoxyanilino)methyl]-4-piperidinecarboxamide IUPAC Name: 4-piperidin-1-yl-1-[(3,4,5-trimethoxyphenyl)carbamothioyl]piperidine-4-carboxamide Traditional Name: 4-piperidino-1-[(3,4,5-trimethoxyphenyl)thiocarbamoyl]isonipecotamide Formula: C21H32N4O4S MolecularWeight: 436.56818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=S)N2CCC(CC2)(C(=O)N)N3CCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=S)N2CCC(CC2)(C(=O)N)N3CCCCC3

InChI

InChI=1S/C21H32N4O4S/c1-27-16-13-15(14-17(28-2)18(16)29-3)23-20(30)24-11-7-21(8-12-24,19(22)26)25-9-5-4-6-10-25/h13-14H,4-12H2,1-3H3,(H2,22,26)(H,23,30)