sodium 4-azanyl-N-(2,6-dimethylpyrimidin-4-yl)benzenesulfonamide

Systemtic Name: sodium 4-azanyl-N-(2,6-dimethylpyrimidin-4-yl)benzenesulfonamide Openeye Name: sodium 4-amino-N-(2,6-dimethylpyrimidin-4-yl)benzenesulfonamide CAS Name: sodium 4-amino-N-(2,6-dimethyl-4-pyrimidinyl)benzenesulfonamide IUPAC Name: sodium 4-amino-N-(2,6-dimethylpyrimidin-4-yl)benzenesulfonamide Traditional Name: sodium 4-amino-N-(2,6-dimethylpyrimidin-4-yl)benzenesulfonamide Formula: C12H14N4NaO2S+ MolecularWeight: 301.31993

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4O2S.Na/c1-8-7-12(15-9(2)14-8)16-19(17,18)11-5-3-10(13)4-6-11;/h3-7H,13H2,1-2H3,(H,14,15,16);/q;+1