methyl 2-[[(4,6-dimethylpyrimidin-2-yl)-[(4-methylphenyl)sulfonylmethyl]carbamoyl]sulfamoyl]benzoate

Systemtic Name: methyl 2-[[(4,6-dimethylpyrimidin-2-yl)-[(4-methylphenyl)sulfonylmethyl]carbamoyl]sulfamoyl]benzoate Openeye Name: methyl 2-[[(4,6-dimethylpyrimidin-2-yl)-(p-tolylsulfonylmethyl)carbamoyl]sulfamoyl]benzoate CAS Name: 2-[[[(4,6-dimethyl-2-pyrimidinyl)-[(4-methylphenyl)sulfonylmethyl]amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[(4,6-dimethylpyrimidin-2-yl)-[(4-methylphenyl)sulfonylmethyl]carbamoyl]sulfamoyl]benzoate Traditional Name: 2-[[(4,6-dimethylpyrimidin-2-yl)-(tosylmethyl)carbamoyl]sulfamoyl]benzoic acid methyl ester Formula: C23H24N4O7S2 MolecularWeight: 532.58926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CN(C2=NC(=CC(=N2)C)C)C(=O)NS(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CN(C2=NC(=CC(=N2)C)C)C(=O)NS(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C23H24N4O7S2/c1-15-9-11-18(12-10-15)35(30,31)14-27(22-24-16(2)13-17(3)25-22)23(29)26-36(32,33)20-8-6-5-7-19(20)21(28)34-4/h5-13H,14H2,1-4H3,(H,26,29)