4-(1H-benzimidazol-2-yl)-N-(2,4-dimethoxyphenyl)piperidine-1-carbothioamide

Systemtic Name: 4-(1H-benzimidazol-2-yl)-N-(2,4-dimethoxyphenyl)piperidine-1-carbothioamide Openeye Name: 4-(1H-benzimidazol-2-yl)-N-(2,4-dimethoxyphenyl)piperidine-1-carbothioamide CAS Name: 4-(1H-benzimidazol-2-yl)-N-(2,4-dimethoxyphenyl)-1-piperidinecarbothioamide IUPAC Name: 4-(1H-benzimidazol-2-yl)-N-(2,4-dimethoxyphenyl)piperidine-1-carbothioamide Traditional Name: 4-(1H-benzimidazol-2-yl)-N-(2,4-dimethoxyphenyl)piperidine-1-carbothioamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=S)N2CCC(CC2)C3=NC4=CC=CC=C4N3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=S)N2CCC(CC2)C3=NC4=CC=CC=C4N3)OC

InChI

InChI=1S/C21H24N4O2S/c1-26-15-7-8-18(19(13-15)27-2)24-21(28)25-11-9-14(10-12-25)20-22-16-5-3-4-6-17(16)23-20/h3-8,13-14H,9-12H2,1-2H3,(H,22,23)(H,24,28)