ethyl 2-[[4-ethoxycarbonyl-6-[(4-sulfamoylphenyl)methylamino]pyrimidin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[[4-ethoxycarbonyl-6-[(4-sulfamoylphenyl)methylamino]pyrimidin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[4-ethoxycarbonyl-6-[(4-sulfamoylphenyl)methylamino]pyrimidin-2-yl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[4-ethoxycarbonyl-6-[(4-sulfamoylphenyl)methylamino]-2-pyrimidinyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-ethoxycarbonyl-6-[(4-sulfamoylphenyl)methylamino]pyrimidin-2-yl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[4-carbethoxy-6-[(4-sulfamoylbenzyl)amino]pyrimidin-2-yl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C21H24N6O6S2 MolecularWeight: 520.58186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NC(=N1)NC2=NC(=C(S2)C(=O)OCC)C)NCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCOC(=O)C1=CC(=NC(=N1)NC2=NC(=C(S2)C(=O)OCC)C)NCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C21H24N6O6S2/c1-4-32-18(28)15-10-16(23-11-13-6-8-14(9-7-13)35(22,30)31)26-20(25-15)27-21-24-12(3)17(34-21)19(29)33-5-2/h6-10H,4-5,11H2,1-3H3,(H2,22,30,31)(H2,23,24,25,26,27)