ethyl 4-(4-aminocarbonylphenyl)-6-ethyl-2-[3-[(5-nitropyridin-2-yl)amino]propylamino]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-aminocarbonylphenyl)-6-ethyl-2-[3-[(5-nitropyridin-2-yl)amino]propylamino]pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-carbamoylphenyl)-6-ethyl-2-[3-[(5-nitro-2-pyridyl)amino]propylamino]pyrimidine-5-carboxylate CAS Name: 4-(4-carbamoylphenyl)-6-ethyl-2-[3-[(5-nitro-2-pyridinyl)amino]propylamino]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-carbamoylphenyl)-6-ethyl-2-[3-[(5-nitropyridin-2-yl)amino]propylamino]pyrimidine-5-carboxylate Traditional Name: 4-(4-carbamoylphenyl)-6-ethyl-2-[3-[(5-nitro-2-pyridyl)amino]propylamino]pyrimidine-5-carboxylic acid ethyl ester Formula: C24H27N7O5 MolecularWeight: 493.51508

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NC(=C1C(=O)OCC)C2=CC=C(C=C2)C(=O)N)NCCCNC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=NC(=NC(=C1C(=O)OCC)C2=CC=C(C=C2)C(=O)N)NCCCNC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H27N7O5/c1-3-18-20(23(33)36-4-2)21(15-6-8-16(9-7-15)22(25)32)30-24(29-18)27-13-5-12-26-19-11-10-17(14-28-19)31(34)35/h6-11,14H,3-5,12-13H2,1-2H3,(H2,25,32)(H,26,28)(H,27,29,30)