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

Systemtic Name: ethyl 3-[4-cyano-3-methyl-1-(phenethylamino)pyrido[1,2-a]benzimidazol-2-yl]propanoate Openeye Name: ethyl 3-[4-cyano-3-methyl-1-(phenethylamino)pyrido[1,2-a]benzimidazol-2-yl]propanoate CAS Name: 3-[4-cyano-3-methyl-1-(phenethylamino)-2-pyrido[1,2-a]benzimidazolyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-cyano-3-methyl-1-(phenethylamino)pyrido[1,2-a]benzimidazol-2-yl]propanoate Traditional Name: 3-[4-cyano-3-methyl-1-(phenethylamino)pyrido[1,2-a]benzimidazol-2-yl]propionic acid ethyl ester Formula: C26H26N4O2 MolecularWeight: 426.51024

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NCCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CCC1=C(N2C3=CC=CC=C3N=C2C(=C1C)C#N)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H26N4O2/c1-3-32-24(31)14-13-20-18(2)21(17-27)26-29-22-11-7-8-12-23(22)30(26)25(20)28-16-15-19-9-5-4-6-10-19/h4-12,28H,3,13-16H2,1-2H3