N-(diphenylmethyl)-4-[2-oxidanylidene-3-(phenylmethyl)benzimidazol-1-yl]piperidine-1-carbothioamide

Systemtic Name: N-(diphenylmethyl)-4-[2-oxidanylidene-3-(phenylmethyl)benzimidazol-1-yl]piperidine-1-carbothioamide Openeye Name: N-benzhydryl-4-(3-benzyl-2-oxo-benzimidazol-1-yl)piperidine-1-carbothioamide CAS Name: N-(diphenylmethyl)-4-[2-oxo-3-(phenylmethyl)-1-benzimidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-benzhydryl-4-(3-benzyl-2-oxobenzimidazol-1-yl)piperidine-1-carbothioamide Traditional Name: N-benzhydryl-4-(3-benzyl-2-keto-benzimidazol-1-yl)piperidine-1-carbothioamide Formula: C33H32N4OS MolecularWeight: 532.69838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3N(C2=O)CC4=CC=CC=C4)C(=S)NC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3N(C2=O)CC4=CC=CC=C4)C(=S)NC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C33H32N4OS/c38-33-36(24-25-12-4-1-5-13-25)29-18-10-11-19-30(29)37(33)28-20-22-35(23-21-28)32(39)34-31(26-14-6-2-7-15-26)27-16-8-3-9-17-27/h1-19,28,31H,20-24H2,(H,34,39)