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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N(CCC(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N(CCC(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4O2/c1-4-19-17(2)20(16-26)24-27-21-12-8-9-13-22(21)29(24)25(19)28(15-14-23(30)31-3)18-10-6-5-7-11-18/h5-13H,4,14-15H2,1-3H3