ethyl 3-[4-cyano-3-methyl-1-[(phenylmethyl)amino]pyrido[1,2-a]benzimidazol-2-yl]propanoate

Systemtic Name: ethyl 3-[4-cyano-3-methyl-1-[(phenylmethyl)amino]pyrido[1,2-a]benzimidazol-2-yl]propanoate Openeye Name: ethyl 3-[1-(benzylamino)-4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-2-yl]propanoate CAS Name: 3-[4-cyano-3-methyl-1-[(phenylmethyl)amino]-2-pyrido[1,2-a]benzimidazolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[1-(benzylamino)-4-cyano-3-methylpyrido[1,2-a]benzimidazol-2-yl]propanoate Traditional Name: 3-[1-(benzylamino)-4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-2-yl]propionic acid ethyl ester Formula: C25H24N4O2 MolecularWeight: 412.48366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NCC4=CC=CC=C4

InChI

InChI=1S/C25H24N4O2/c1-3-31-23(30)14-13-19-17(2)20(15-26)25-28-21-11-7-8-12-22(21)29(25)24(19)27-16-18-9-5-4-6-10-18/h4-12,27H,3,13-14,16H2,1-2H3