2-morpholin-4-ylethyl 4-(4-cyanophenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidine-5-carboxylate

Systemtic Name: 2-morpholin-4-ylethyl 4-(4-cyanophenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidine-5-carboxylate Openeye Name: 2-morpholinoethyl 4-(4-cyanophenyl)-2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidine-5-carboxylate CAS Name: 4-(4-cyanophenyl)-2-[2-[(5-nitro-2-pyridinyl)amino]ethylamino]-5-pyrimidinecarboxylic acid 2-(4-morpholinyl)ethyl ester IUPAC Name: 2-morpholin-4-ylethyl 4-(4-cyanophenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]pyrimidine-5-carboxylate Traditional Name: 4-(4-cyanophenyl)-2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]pyrimidine-5-carboxylic acid 2-morpholinoethyl ester Formula: C25H26N8O5 MolecularWeight: 518.52454

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCOC(=O)C2=CN=C(N=C2C3=CC=C(C=C3)C#N)NCCNC4=NC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCOC(=O)C2=CN=C(N=C2C3=CC=C(C=C3)C#N)NCCNC4=NC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H26N8O5/c26-15-18-1-3-19(4-2-18)23-21(24(34)38-14-11-32-9-12-37-13-10-32)17-30-25(31-23)28-8-7-27-22-6-5-20(16-29-22)33(35)36/h1-6,16-17H,7-14H2,(H,27,29)(H,28,30,31)