ethyl 4-(4-aminocarbonylphenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethyl]-6-pyridin-4-yl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-aminocarbonylphenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethyl]-6-pyridin-4-yl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-carbamoylphenyl)-2-[2-[(5-nitro-2-pyridyl)amino]ethyl]-6-(4-pyridyl)pyrimidine-5-carboxylate CAS Name: 4-(4-carbamoylphenyl)-2-[2-[(5-nitro-2-pyridinyl)amino]ethyl]-6-pyridin-4-yl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-carbamoylphenyl)-2-[2-[(5-nitropyridin-2-yl)amino]ethyl]-6-pyridin-4-ylpyrimidine-5-carboxylate Traditional Name: 4-(4-carbamoylphenyl)-2-[2-[(5-nitro-2-pyridyl)amino]ethyl]-6-(4-pyridyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C26H23N7O5 MolecularWeight: 513.50472

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1C2=CC=NC=C2)CCNC3=NC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)C(=O)N

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1C2=CC=NC=C2)CCNC3=NC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C26H23N7O5/c1-2-38-26(35)22-23(16-3-5-18(6-4-16)25(27)34)31-21(32-24(22)17-9-12-28-13-10-17)11-14-29-20-8-7-19(15-30-20)33(36)37/h3-10,12-13,15H,2,11,14H2,1H3,(H2,27,34)(H,29,30)