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

Systemtic Name: ethyl 2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]-4-(4-sulfamoylphenyl)pyrimidine-5-carboxylate Openeye Name: ethyl 2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]-4-(4-sulfamoylphenyl)pyrimidine-5-carboxylate CAS Name: 2-[2-[(5-nitro-2-pyridinyl)amino]ethylamino]-4-(4-sulfamoylphenyl)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-[(5-nitropyridin-2-yl)amino]ethylamino]-4-(4-sulfamoylphenyl)pyrimidine-5-carboxylate Traditional Name: 2-[2-[(5-nitro-2-pyridyl)amino]ethylamino]-4-(4-sulfamoylphenyl)pyrimidine-5-carboxylic acid ethyl ester Formula: C20H21N7O6S MolecularWeight: 487.48904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1C2=CC=C(C=C2)S(=O)(=O)N)NCCNC3=NC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1C2=CC=C(C=C2)S(=O)(=O)N)NCCNC3=NC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N7O6S/c1-2-33-19(28)16-12-25-20(23-10-9-22-17-8-5-14(11-24-17)27(29)30)26-18(16)13-3-6-15(7-4-13)34(21,31)32/h3-8,11-12H,2,9-10H2,1H3,(H,22,24)(H2,21,31,32)(H,23,25,26)