sodium N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamate

Systemtic Name: sodium N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamate Openeye Name: sodium N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamate CAS Name: sodium N-[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]phenyl]sulfamate IUPAC Name: sodium N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamate Traditional Name: sodium N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]sulfamate Formula: C12H13N4NaO5S2 MolecularWeight: 380.37519

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)[O-])C.[Na+]

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)[O-])C.[Na+]

InChI

InChI=1S/C12H14N4O5S2.Na/c1-8-7-9(2)14-12(13-8)16-22(17,18)11-5-3-10(4-6-11)15-23(19,20)21;/h3-7,15H,1-2H3,(H,13,14,16)(H,19,20,21);/q;+1/p-1