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

Systemtic Name: methyl 3-[(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)-phenyl-amino]propanoate Openeye Name: methyl 3-(N-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)anilino)propanoate CAS Name: 3-(N-(4-cyano-3-methyl-1-pyrido[1,2-a]benzimidazolyl)anilino)propanoic acid methyl ester IUPAC Name: methyl 3-(N-(4-cyano-3-methylpyrido[1,2-a]benzimidazol-1-yl)anilino)propanoate Traditional Name: 3-(N-(4-cyano-3-methyl-pyrido[1,2-a]benzimidazol-1-yl)anilino)propionic acid methyl ester Formula: C23H20N4O2 MolecularWeight: 384.4305

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N4O2/c1-16-14-21(26(13-12-22(28)29-2)17-8-4-3-5-9-17)27-20-11-7-6-10-19(20)25-23(27)18(16)15-24/h3-11,14H,12-13H2,1-2H3