[1-phenyl-2-(phenylmethoxycarbonylamino)propyl] 2-azanyl-5-cyano-6-methyl-4-(3-phenylquinolin-5-yl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: [1-phenyl-2-(phenylmethoxycarbonylamino)propyl] 2-azanyl-5-cyano-6-methyl-4-(3-phenylquinolin-5-yl)-1,4-dihydropyridine-3-carboxylate Openeye Name: [2-(benzyloxycarbonylamino)-1-phenyl-propyl] 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 [1-phenyl-2-(phenylmethoxycarbonylamino)propyl] ester IUPAC Name: [1-phenyl-2-(phenylmethoxycarbonylamino)propyl] 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 [2-(benzyloxycarbonylamino)-1-phenyl-propyl] ester Formula: C40H35N5O4 MolecularWeight: 649.737

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)N)C(=O)OC(C2=CC=CC=C2)C(C)NC(=O)OCC3=CC=CC=C3)C4=C5C=C(C=NC5=CC=C4)C6=CC=CC=C6)C#N

Isomeric SMILES

CC1=C(C(C(=C(N1)N)C(=O)OC(C2=CC=CC=C2)C(C)NC(=O)OCC3=CC=CC=C3)C4=C5C=C(C=NC5=CC=C4)C6=CC=CC=C6)C#N

InChI

InChI=1S/C40H35N5O4/c1-25-33(22-41)35(31-19-12-20-34-32(31)21-30(23-43-34)28-15-8-4-9-16-28)36(38(42)44-25)39(46)49-37(29-17-10-5-11-18-29)26(2)45-40(47)48-24-27-13-6-3-7-14-27/h3-21,23,26,35,37,44H,24,42H2,1-2H3,(H,45,47)