N-(diphenylmethyl)-4-[5-methyl-2-oxidanylidene-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]piperidine-1-carbothioamide

Systemtic Name: N-(diphenylmethyl)-4-[5-methyl-2-oxidanylidene-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Openeye Name: N-benzhydryl-4-[5-methyl-2-oxo-3-[3-(1-piperidyl)propyl]benzimidazol-1-yl]piperidine-1-carbothioamide CAS Name: N-(diphenylmethyl)-4-[5-methyl-2-oxo-3-[3-(1-piperidinyl)propyl]-1-benzimidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-benzhydryl-4-[5-methyl-2-oxo-3-(3-piperidin-1-ylpropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Traditional Name: N-benzhydryl-4-[2-keto-5-methyl-3-(3-piperidinopropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Formula: C35H43N5OS MolecularWeight: 581.81382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)N2CCCN3CCCCC3)C4CCN(CC4)C(=S)NC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)N2CCCN3CCCCC3)C4CCN(CC4)C(=S)NC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C35H43N5OS/c1-27-16-17-31-32(26-27)39(23-11-22-37-20-9-4-10-21-37)35(41)40(31)30-18-24-38(25-19-30)34(42)36-33(28-12-5-2-6-13-28)29-14-7-3-8-15-29/h2-3,5-8,12-17,26,30,33H,4,9-11,18-25H2,1H3,(H,36,42)