2-[(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)amino]-6-[(4-sulfamoylphenyl)methylamino]pyrimidine-4-carboxylic acid

Systemtic Name: 2-[(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)amino]-6-[(4-sulfamoylphenyl)methylamino]pyrimidine-4-carboxylic acid Openeye Name: 2-[(5-ethoxycarbonyl-4-methyl-thiazol-2-yl)amino]-6-[(4-sulfamoylphenyl)methylamino]pyrimidine-4-carboxylic acid CAS Name: 2-[(5-ethoxycarbonyl-4-methyl-2-thiazolyl)amino]-6-[(4-sulfamoylphenyl)methylamino]-4-pyrimidinecarboxylic acid IUPAC Name: 2-[(5-ethoxycarbonyl-4-methyl-1,3-thiazol-2-yl)amino]-6-[(4-sulfamoylphenyl)methylamino]pyrimidine-4-carboxylic acid Traditional Name: 2-[(5-carbethoxy-4-methyl-thiazol-2-yl)amino]-6-[(4-sulfamoylbenzyl)amino]pyrimidine-4-carboxylic acid Formula: C19H20N6O6S2 MolecularWeight: 492.5287

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(S1)NC2=NC(=CC(=N2)NCC3=CC=C(C=C3)S(=O)(=O)N)C(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)NC2=NC(=CC(=N2)NCC3=CC=C(C=C3)S(=O)(=O)N)C(=O)O)C

InChI

InChI=1S/C19H20N6O6S2/c1-3-31-17(28)15-10(2)22-19(32-15)25-18-23-13(16(26)27)8-14(24-18)21-9-11-4-6-12(7-5-11)33(20,29)30/h4-8H,3,9H2,1-2H3,(H,26,27)(H2,20,29,30)(H2,21,22,23,24,25)