4-(2-oxidanylidene-3H-benzimidazol-1-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]piperidine-1-carbothioamide

Systemtic Name: 4-(2-oxidanylidene-3H-benzimidazol-1-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]piperidine-1-carbothioamide Openeye Name: 4-(2-oxo-3H-benzimidazol-1-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]piperidine-1-carbothioamide CAS Name: 4-(2-oxo-3H-benzimidazol-1-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1-piperidinecarbothioamide IUPAC Name: 4-(2-oxo-3H-benzimidazol-1-yl)-N-[(3,4,5-trimethoxyphenyl)methyl]piperidine-1-carbothioamide Traditional Name: 4-(2-keto-3H-benzimidazol-1-yl)-N-(3,4,5-trimethoxybenzyl)piperidine-1-carbothioamide Formula: C23H28N4O4S MolecularWeight: 456.55782

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=S)N2CCC(CC2)N3C4=CC=CC=C4NC3=O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=S)N2CCC(CC2)N3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C23H28N4O4S/c1-29-19-12-15(13-20(30-2)21(19)31-3)14-24-23(32)26-10-8-16(9-11-26)27-18-7-5-4-6-17(18)25-22(27)28/h4-7,12-13,16H,8-11,14H2,1-3H3,(H,24,32)(H,25,28)