3,4-dimethyl-5-[(3-pyrimidin-2-yloxyphenyl)sulfamoyl]benzoic acid

Systemtic Name: 3,4-dimethyl-5-[(3-pyrimidin-2-yloxyphenyl)sulfamoyl]benzoic acid Openeye Name: 3,4-dimethyl-5-[(3-pyrimidin-2-yloxyphenyl)sulfamoyl]benzoic acid CAS Name: 3,4-dimethyl-5-[[3-(2-pyrimidinyloxy)phenyl]sulfamoyl]benzoic acid IUPAC Name: 3,4-dimethyl-5-[(3-pyrimidin-2-yloxyphenyl)sulfamoyl]benzoic acid Traditional Name: 3,4-dimethyl-5-[[3-(2-pyrimidyloxy)phenyl]sulfamoyl]benzoic acid Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NC2=CC(=CC=C2)OC3=NC=CC=N3)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)NC2=CC(=CC=C2)OC3=NC=CC=N3)C

InChI

InChI=1S/C19H17N3O5S/c1-12-9-14(18(23)24)10-17(13(12)2)28(25,26)22-15-5-3-6-16(11-15)27-19-20-7-4-8-21-19/h3-11,22H,1-2H3,(H,23,24)