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

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-4-[2-oxidanylidene-3-(phenylmethyl)benzimidazol-1-yl]piperidine-1-carbothioamide Openeye Name: 4-(3-benzyl-2-oxo-benzimidazol-1-yl)-N-[2-(4-chlorophenyl)ethyl]piperidine-1-carbothioamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-4-[2-oxo-3-(phenylmethyl)-1-benzimidazolyl]-1-piperidinecarbothioamide IUPAC Name: 4-(3-benzyl-2-oxobenzimidazol-1-yl)-N-[2-(4-chlorophenyl)ethyl]piperidine-1-carbothioamide Traditional Name: 4-(3-benzyl-2-keto-benzimidazol-1-yl)-N-[2-(4-chlorophenyl)ethyl]piperidine-1-carbothioamide Formula: C28H29ClN4OS MolecularWeight: 505.07406

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3N(C2=O)CC4=CC=CC=C4)C(=S)NCCC5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3N(C2=O)CC4=CC=CC=C4)C(=S)NCCC5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H29ClN4OS/c29-23-12-10-21(11-13-23)14-17-30-27(35)31-18-15-24(16-19-31)33-26-9-5-4-8-25(26)32(28(33)34)20-22-6-2-1-3-7-22/h1-13,24H,14-20H2,(H,30,35)