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

Systemtic Name: 2-(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(2-methylpropylcarbamoyl)ethanamide Openeye Name: 2-(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(isobutylcarbamoyl)acetamide CAS Name: 2-[(4-cyano-3-ethyl-1-pyrido[1,2-a]benzimidazolyl)thio]-N-[(2-methylpropylamino)-oxomethyl]acetamide IUPAC Name: 2-(4-cyano-3-ethylpyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(2-methylpropylcarbamoyl)acetamide Traditional Name: 2-[(4-cyano-3-ethyl-pyrido[1,2-a]benzimidazol-1-yl)thio]-N-(isobutylcarbamoyl)acetamide Formula: C21H23N5O2S MolecularWeight: 409.50462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)NC(=O)NCC(C)C)C#N

Isomeric SMILES

CCC1=C(C2=NC3=CC=CC=C3N2C(=C1)SCC(=O)NC(=O)NCC(C)C)C#N

InChI

InChI=1S/C21H23N5O2S/c1-4-14-9-19(29-12-18(27)25-21(28)23-11-13(2)3)26-17-8-6-5-7-16(17)24-20(26)15(14)10-22/h5-9,13H,4,11-12H2,1-3H3,(H2,23,25,27,28)