4-[2-oxidanylidene-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]-N-(1-phenylethyl)piperidine-1-carbothioamide

Systemtic Name: 4-[2-oxidanylidene-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]-N-(1-phenylethyl)piperidine-1-carbothioamide Openeye Name: 4-[2-oxo-3-[3-(1-piperidyl)propyl]benzimidazol-1-yl]-N-(1-phenylethyl)piperidine-1-carbothioamide CAS Name: 4-[2-oxo-3-[3-(1-piperidinyl)propyl]-1-benzimidazolyl]-N-(1-phenylethyl)-1-piperidinecarbothioamide IUPAC Name: 4-[2-oxo-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]-N-(1-phenylethyl)piperidine-1-carbothioamide Traditional Name: 4-[2-keto-3-(3-piperidinopropyl)benzimidazol-1-yl]-N-(1-phenylethyl)piperidine-1-carbothioamide Formula: C29H39N5OS MolecularWeight: 505.71786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=S)N2CCC(CC2)N3C4=CC=CC=C4N(C3=O)CCCN5CCCCC5

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=S)N2CCC(CC2)N3C4=CC=CC=C4N(C3=O)CCCN5CCCCC5

InChI

InChI=1S/C29H39N5OS/c1-23(24-11-4-2-5-12-24)30-28(36)32-21-15-25(16-22-32)34-27-14-7-6-13-26(27)33(29(34)35)20-10-19-31-17-8-3-9-18-31/h2,4-7,11-14,23,25H,3,8-10,15-22H2,1H3,(H,30,36)