(3S)-1-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)piperidine-3-carboxamide

Systemtic Name: (3S)-1-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)piperidine-3-carboxamide Openeye Name: (3S)-1-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)piperidine-3-carboxamide CAS Name: (3S)-1-(4-cyano-3-methyl-1-pyrido[1,2-a]benzimidazolyl)-3-piperidinecarboxamide IUPAC Name: (3S)-1-(4-cyano-3-methylpyrido[1,2-a]benzimidazol-1-yl)piperidine-3-carboxamide Traditional Name: (3S)-1-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)nipecotamide Formula: C19H19N5O MolecularWeight: 333.38706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCCC(C4)C(=O)N)C#N

Isomeric SMILES

CC1=C(C2=NC3=CC=CC=C3N2C(=C1)N4CCC[C@@H](C4)C(=O)N)C#N

InChI

InChI=1S/C19H19N5O/c1-12-9-17(23-8-4-5-13(11-23)18(21)25)24-16-7-3-2-6-15(16)22-19(24)14(12)10-20/h2-3,6-7,9,13H,4-5,8,11H2,1H3,(H2,21,25)/t13-/m0/s1