ethyl 2-azanyl-5-cyano-6-methyl-4-(3-phenylquinolin-5-yl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 2-azanyl-5-cyano-6-methyl-4-(3-phenylquinolin-5-yl)-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 2-amino-5-cyano-6-methyl-4-(3-phenyl-5-quinolyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 2-amino-5-cyano-6-methyl-4-(3-phenyl-5-quinolinyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-5-cyano-6-methyl-4-(3-phenylquinolin-5-yl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 2-amino-5-cyano-6-methyl-4-(3-phenyl-5-quinolyl)-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C25H22N4O2 MolecularWeight: 410.46778

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=C3C=C(C=NC3=CC=C2)C4=CC=CC=C4)C#N)C)N

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=C3C=C(C=NC3=CC=C2)C4=CC=CC=C4)C#N)C)N

InChI

InChI=1S/C25H22N4O2/c1-3-31-25(30)23-22(20(13-26)15(2)29-24(23)27)18-10-7-11-21-19(18)12-17(14-28-21)16-8-5-4-6-9-16/h4-12,14,22,29H,3,27H2,1-2H3