3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamoyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]anilino]-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]carbamoyl]pyrazinoic acid Formula: C18H16N6O5S MolecularWeight: 428.42184

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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=NC=CN=C3C(=O)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NC=CN=C3C(=O)O)C

InChI

InChI=1S/C18H16N6O5S/c1-10-9-11(2)22-18(21-10)24-30(28,29)13-5-3-12(4-6-13)23-16(25)14-15(17(26)27)20-8-7-19-14/h3-9H,1-2H3,(H,23,25)(H,26,27)(H,21,22,24)