Molecule ID: 3641960

IUPAC Name: sodium;chloro-(4-methylphenyl)sulfonylazanide

Description: The molecule is an organic sodium salt derivative of toluene-4-sulfonamide with a chloro substituent in place of an amino hydrogen. It has a role as an antifouling biocide, a disinfectant and an allergen. It contains a chloro(p-tolylsulfonyl)azanide.

SMILES: Cc1ccc(S(=O)(=O)[N-]Cl)cc1.[Na+]

SELFIES: [C][C][=C][C][=C][Branch1][#Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N-1][Cl][C][=C][Ring1][O].[Na+1]

InChI: InChI=1S/C7H7ClNO2S.Na/c1-6-2-4-7(5-3-6)12(10,11)9-8;/h2-5H,1H3;/q-1;+1

Molecular Properties:
- Polar Surface Area: 43.5 Ų
- LogP: nan