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

Systemtic Name: 4-[3-(4-azanylbutyl)-2-oxidanylidene-benzimidazol-1-yl]-N-(diphenylmethyl)piperidine-1-carbothioamide Openeye Name: 4-[3-(4-aminobutyl)-2-oxo-benzimidazol-1-yl]-N-benzhydryl-piperidine-1-carbothioamide CAS Name: 4-[3-(4-aminobutyl)-2-oxo-1-benzimidazolyl]-N-(diphenylmethyl)-1-piperidinecarbothioamide IUPAC Name: 4-[3-(4-aminobutyl)-2-oxobenzimidazol-1-yl]-N-benzhydrylpiperidine-1-carbothioamide Traditional Name: 4-[3-(4-aminobutyl)-2-keto-benzimidazol-1-yl]-N-benzhydryl-piperidine-1-carbothioamide Formula: C30H35N5OS MolecularWeight: 513.6968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H35N5OS/c31-19-9-10-20-34-26-15-7-8-16-27(26)35(30(34)36)25-17-21-33(22-18-25)29(37)32-28(23-11-3-1-4-12-23)24-13-5-2-6-14-24/h1-8,11-16,25,28H,9-10,17-22,31H2,(H,32,37)