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

Systemtic Name: 4-[2-oxidanylidene-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]-N-(3-phenylpropyl)piperidine-1-carbothioamide Openeye Name: 4-[2-oxo-3-[3-(1-piperidyl)propyl]benzimidazol-1-yl]-N-(3-phenylpropyl)piperidine-1-carbothioamide CAS Name: 4-[2-oxo-3-[3-(1-piperidinyl)propyl]-1-benzimidazolyl]-N-(3-phenylpropyl)-1-piperidinecarbothioamide IUPAC Name: 4-[2-oxo-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]-N-(3-phenylpropyl)piperidine-1-carbothioamide Traditional Name: 4-[2-keto-3-(3-piperidinopropyl)benzimidazol-1-yl]-N-(3-phenylpropyl)piperidine-1-carbothioamide Formula: C30H41N5OS MolecularWeight: 519.74444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCN2C3=CC=CC=C3N(C2=O)C4CCN(CC4)C(=S)NCCCC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)CCCN2C3=CC=CC=C3N(C2=O)C4CCN(CC4)C(=S)NCCCC5=CC=CC=C5

InChI

InChI=1S/C30H41N5OS/c36-30-34(22-10-21-32-19-7-2-8-20-32)27-14-5-6-15-28(27)35(30)26-16-23-33(24-17-26)29(37)31-18-9-13-25-11-3-1-4-12-25/h1,3-6,11-12,14-15,26H,2,7-10,13,16-24H2,(H,31,37)