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

Systemtic Name: N-(diphenylmethyl)-4-[2-oxidanylidene-3-(3-oxidanylpropyl)benzimidazol-1-yl]piperidine-1-carbothioamide Openeye Name: N-benzhydryl-4-[3-(3-hydroxypropyl)-2-oxo-benzimidazol-1-yl]piperidine-1-carbothioamide CAS Name: N-(diphenylmethyl)-4-[3-(3-hydroxypropyl)-2-oxo-1-benzimidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-benzhydryl-4-[3-(3-hydroxypropyl)-2-oxobenzimidazol-1-yl]piperidine-1-carbothioamide Traditional Name: N-benzhydryl-4-[3-(3-hydroxypropyl)-2-keto-benzimidazol-1-yl]piperidine-1-carbothioamide Formula: C29H32N4O2S MolecularWeight: 500.65498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H32N4O2S/c34-21-9-18-32-25-14-7-8-15-26(25)33(29(32)35)24-16-19-31(20-17-24)28(36)30-27(22-10-3-1-4-11-22)23-12-5-2-6-13-23/h1-8,10-15,24,27,34H,9,16-21H2,(H,30,36)