N-(3-cyanophenyl)-4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-1-carbothioamide

Systemtic Name: N-(3-cyanophenyl)-4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Openeye Name: N-(3-cyanophenyl)-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbothioamide CAS Name: N-(3-cyanophenyl)-4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinecarbothioamide IUPAC Name: N-(3-cyanophenyl)-4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Traditional Name: N-(3-cyanophenyl)-4-(2-keto-3H-benzimidazol-1-yl)piperidine-1-carbothioamide Formula: C20H19N5OS MolecularWeight: 377.46276

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=S)NC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=S)NC4=CC=CC(=C4)C#N

InChI

InChI=1S/C20H19N5OS/c21-13-14-4-3-5-15(12-14)22-20(27)24-10-8-16(9-11-24)25-18-7-2-1-6-17(18)23-19(25)26/h1-7,12,16H,8-11H2,(H,22,27)(H,23,26)