2-azanyl-5-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]diazenyl]benzoic acid

Systemtic Name: 2-azanyl-5-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]diazenyl]benzoic acid Openeye Name: 2-amino-5-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]azo-benzoic acid CAS Name: 2-amino-5-[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]phenyl]azobenzoic acid IUPAC Name: 2-amino-5-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]diazenyl]benzoic acid Traditional Name: 2-amino-5-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]azo-benzoic acid Formula: C19H18N6O4S MolecularWeight: 426.44902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N=NC3=CC(=C(C=C3)N)C(=O)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N=NC3=CC(=C(C=C3)N)C(=O)O)C

InChI

InChI=1S/C19H18N6O4S/c1-11-9-12(2)22-19(21-11)25-30(28,29)15-6-3-13(4-7-15)23-24-14-5-8-17(20)16(10-14)18(26)27/h3-10H,20H2,1-2H3,(H,26,27)(H,21,22,25)