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

Systemtic Name: ethyl 4-(4-morpholin-4-ylphenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-morpholinophenyl)-2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidine-5-carboxylate CAS Name: 4-[4-(4-morpholinyl)phenyl]-2-[2-[(5-nitro-2-pyridinyl)amino]ethylamino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-morpholin-4-ylphenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidine-5-carboxylate Traditional Name: 4-(4-morpholinophenyl)-2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidine-5-carboxylic acid ethyl ester Formula: C24H27N7O5 MolecularWeight: 493.51508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1C2=CC=C(C=C2)N3CCOCC3)NCCNC4=NC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1C2=CC=C(C=C2)N3CCOCC3)NCCNC4=NC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H27N7O5/c1-2-36-23(32)20-16-28-24(26-10-9-25-21-8-7-19(15-27-21)31(33)34)29-22(20)17-3-5-18(6-4-17)30-11-13-35-14-12-30/h3-8,15-16H,2,9-14H2,1H3,(H,25,27)(H,26,28,29)