4-methyl-3-[[3-(2-methylpyrimidin-4-yl)phenyl]sulfamoyl]benzoic acid

Systemtic Name: 4-methyl-3-[[3-(2-methylpyrimidin-4-yl)phenyl]sulfamoyl]benzoic acid Openeye Name: 4-methyl-3-[[3-(2-methylpyrimidin-4-yl)phenyl]sulfamoyl]benzoic acid CAS Name: 4-methyl-3-[[3-(2-methyl-4-pyrimidinyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 4-methyl-3-[[3-(2-methylpyrimidin-4-yl)phenyl]sulfamoyl]benzoic acid Traditional Name: 4-methyl-3-[[3-(2-methylpyrimidin-4-yl)phenyl]sulfamoyl]benzoic acid Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC=CC(=C2)C3=NC(=NC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC=CC(=C2)C3=NC(=NC=C3)C

InChI

InChI=1S/C19H17N3O4S/c1-12-6-7-15(19(23)24)11-18(12)27(25,26)22-16-5-3-4-14(10-16)17-8-9-20-13(2)21-17/h3-11,22H,1-2H3,(H,23,24)