ethyl 3-bromanyl-2-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoyl]-1-methyl-5-sulfamoyl-3H-pyrazole-4-carboxylate

Systemtic Name: ethyl 3-bromanyl-2-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoyl]-1-methyl-5-sulfamoyl-3H-pyrazole-4-carboxylate Openeye Name: ethyl 3-bromo-2-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoyl]-1-methyl-5-sulfamoyl-3H-pyrazole-4-carboxylate CAS Name: 3-bromo-2-[[(4-methoxy-6-methyl-2-pyrimidinyl)amino]-oxomethyl]-1-methyl-5-sulfamoyl-3H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 3-bromo-2-[(4-methoxy-6-methylpyrimidin-2-yl)carbamoyl]-1-methyl-5-sulfamoyl-3H-pyrazole-4-carboxylate Traditional Name: 5-bromo-1-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoyl]-2-methyl-3-sulfamoyl-3-pyrazoline-4-carboxylic acid ethyl ester Formula: C14H19BrN6O6S MolecularWeight: 479.30626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N(C1Br)C(=O)NC2=NC(=CC(=N2)OC)C)C)S(=O)(=O)N

Isomeric SMILES

CCOC(=O)C1=C(N(N(C1Br)C(=O)NC2=NC(=CC(=N2)OC)C)C)S(=O)(=O)N

InChI

InChI=1S/C14H19BrN6O6S/c1-5-27-12(22)9-10(15)21(20(3)11(9)28(16,24)25)14(23)19-13-17-7(2)6-8(18-13)26-4/h6,10H,5H2,1-4H3,(H2,16,24,25)(H,17,18,19,23)