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

Systemtic Name: N-[2-(3-chlorophenyl)ethyl]-4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Openeye Name: N-[2-(3-chlorophenyl)ethyl]-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbothioamide CAS Name: N-[2-(3-chlorophenyl)ethyl]-4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinecarbothioamide IUPAC Name: N-[2-(3-chlorophenyl)ethyl]-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Traditional Name: N-[2-(3-chlorophenyl)ethyl]-4-(2-keto-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Formula: C21H23ClN4OS MolecularWeight: 414.95152

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=S)NCCC4=CC(=CC=C4)Cl

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=S)NCCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H23ClN4OS/c22-16-5-3-4-15(14-16)8-11-23-21(28)25-12-9-17(10-13-25)26-19-7-2-1-6-18(19)24-20(26)27/h1-7,14,17H,8-13H2,(H,23,28)(H,24,27)