methyl 3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamoyl]benzoate

Systemtic Name: methyl 3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamoyl]benzoate Openeye Name: methyl 3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamoyl]benzoate CAS Name: 3-[[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]anilino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamoyl]benzoate Traditional Name: 3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamoyl]benzoic acid methyl ester Formula: C21H20N4O5S MolecularWeight: 440.4723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)C(=O)OC)C

InChI

InChI=1S/C21H20N4O5S/c1-13-11-14(2)23-21(22-13)25-31(28,29)18-9-7-17(8-10-18)24-19(26)15-5-4-6-16(12-15)20(27)30-3/h4-12H,1-3H3,(H,24,26)(H,22,23,25)