ethyl 2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]-4-(4-phenylphenyl)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]-4-(4-phenylphenyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]-4-(4-phenylphenyl)pyrimidine-5-carboxylate CAS Name: 2-[2-[(5-nitro-2-pyridinyl)amino]ethylamino]-4-(4-phenylphenyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]-4-(4-phenylphenyl)pyrimidine-5-carboxylate Traditional Name: 2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]-4-(4-phenylphenyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C26H24N6O4 MolecularWeight: 484.50656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1C2=CC=C(C=C2)C3=CC=CC=C3)NCCNC4=NC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1C2=CC=C(C=C2)C3=CC=CC=C3)NCCNC4=NC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H24N6O4/c1-2-36-25(33)22-17-30-26(28-15-14-27-23-13-12-21(16-29-23)32(34)35)31-24(22)20-10-8-19(9-11-20)18-6-4-3-5-7-18/h3-13,16-17H,2,14-15H2,1H3,(H,27,29)(H,28,30,31)