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

Systemtic Name: methyl 3-chloranyl-2-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoyl]-1-methyl-5-sulfamoyl-3H-pyrazole-4-carboxylate Openeye Name: methyl 3-chloro-2-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoyl]-1-methyl-5-sulfamoyl-3H-pyrazole-4-carboxylate CAS Name: 3-chloro-2-[[(4-methoxy-6-methyl-2-pyrimidinyl)amino]-oxomethyl]-1-methyl-5-sulfamoyl-3H-pyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 3-chloro-2-[(4-methoxy-6-methylpyrimidin-2-yl)carbamoyl]-1-methyl-5-sulfamoyl-3H-pyrazole-4-carboxylate Traditional Name: 5-chloro-1-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoyl]-2-methyl-3-sulfamoyl-3-pyrazoline-4-carboxylic acid methyl ester Formula: C13H17ClN6O6S MolecularWeight: 420.82868

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)N2C(C(=C(N2C)S(=O)(=O)N)C(=O)OC)Cl)OC

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)N2C(C(=C(N2C)S(=O)(=O)N)C(=O)OC)Cl)OC

InChI

InChI=1S/C13H17ClN6O6S/c1-6-5-7(25-3)17-12(16-6)18-13(22)20-9(14)8(11(21)26-4)10(19(20)2)27(15,23)24/h5,9H,1-4H3,(H2,15,23,24)(H,16,17,18,22)