Sodium 4-(benzothiazol-2-yl)phenylsulphamate

HCID 23717892
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Basic information

Standard SMILES
O=S(=O)([O-])Nc1ccc(-c2nc3ccccc3s2)cc1.[Na+]
InChIKey
CYXOSXBXVPCZNJ-UHFFFAOYSA-M
Molecular formula
C13H9N2NaO3S2
Average molar mass
328.3 g/mol
Monoisotopic mass
327.99522878

Names & identifiers

Preferred name
Sodium 4-(benzothiazol-2-yl)phenylsulphamate
IUPAC
sodium N-[4-(1,3-benzothiazol-2-yl)phenyl]sulfamate

Names & synonyms

CHEMBL418711SCHEMBL7109439CYXOSXBXVPCZNJ-UHFFFAOYSA-MSodium 4-(benzothiazol-2-yl)phenylsulphamate

Database identifiers

PubChem CID
23717892
ChEMBL
CHEMBL418711
Nikkaji
J1.523.563B

Properties

Computed structural properties

Topological polar surface area
119 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
21

Related reactions

1 records
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Compound notes

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