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

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbothioamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinecarbothioamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Traditional Name: N-[2-(4-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=C(C=C4)Cl

Isomeric SMILES

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

InChI

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