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

Systemtic Name: ethyl 3-(4-cyano-1-imidazol-1-yl-3-methyl-pyrido[1,2-a]benzimidazol-2-yl)propanoate Openeye Name: ethyl 3-(4-cyano-1-imidazol-1-yl-3-methyl-pyrido[1,2-a]benzimidazol-2-yl)propanoate CAS Name: 3-[4-cyano-1-(1-imidazolyl)-3-methyl-2-pyrido[1,2-a]benzimidazolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-cyano-1-imidazol-1-yl-3-methylpyrido[1,2-a]benzimidazol-2-yl)propanoate Traditional Name: 3-(4-cyano-1-imidazol-1-yl-3-methyl-pyrido[1,2-a]benzimidazol-2-yl)propionic acid ethyl ester Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4C=CN=C4

Isomeric SMILES

CCOC(=O)CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)N4C=CN=C4

InChI

InChI=1S/C21H19N5O2/c1-3-28-19(27)9-8-15-14(2)16(12-22)20-24-17-6-4-5-7-18(17)26(20)21(15)25-11-10-23-13-25/h4-7,10-11,13H,3,8-9H2,1-2H3