N-(1-cyanocyclopentyl)-2-(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-ethanamide

Systemtic Name: N-(1-cyanocyclopentyl)-2-(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-ethanamide Openeye Name: N-(1-cyanocyclopentyl)-2-(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-acetamide CAS Name: N-(1-cyanocyclopentyl)-2-[(4-cyano-3-ethyl-1-pyrido[1,2-a]benzimidazolyl)thio]acetamide IUPAC Name: N-(1-cyanocyclopentyl)-2-(4-cyano-3-ethylpyrido[1,2-a]benzimidazol-1-yl)sulfanylacetamide Traditional Name: N-(1-cyanocyclopentyl)-2-[(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)thio]acetamide Formula: C22H21N5OS MolecularWeight: 403.50004

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)NC4(CCCC4)C#N)C#N

Isomeric SMILES

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)NC4(CCCC4)C#N)C#N

InChI

InChI=1S/C22H21N5OS/c1-2-15-11-20(29-13-19(28)26-22(14-24)9-5-6-10-22)27-18-8-4-3-7-17(18)25-21(27)16(15)12-23/h3-4,7-8,11H,2,5-6,9-10,13H2,1H3,(H,26,28)