Basic information
- CAS
790271-20-4- Standard SMILES
Cn1c(=S)[nH]c2cc(S(N)(=O)=O)ccc21- InChIKey
DERBQFJCXQRUTC-UHFFFAOYSA-N- Molecular formula
- C8H9N3O2S2
- Average molar mass
- 243.3 g/mol
- Monoisotopic mass
- 243.01361889
Names & identifiers
- Preferred name
- 1-methyl-2-sulfanyl-1H-1,3-benzodiazole-5-sulfonamide
- IUPAC
- 1-methyl-2-sulfanylidene-3H-benzimidazole-5-sulfonamide
- English name
- 1-methyl-2-sulfanyl-1H-1,3-benzodiazole-5-sulfonamide
- Molecular formula
- C8H9N3O2S2
- Molecular weight
- 243.31
Names & synonyms
790271-20-41-methyl-2-sulfanyl-1H-1,3-benzodiazole-5-sulfonamide2-mercapto-1-methyl-1H-benzimidazole-5-sulfonamideMFCD063578881-methyl-2-sulfanylidene-3H-benzimidazole-5-sulfonamideDTXSID801183940HMS1719H13QGB27120AKOS008967761CS-0222034EN300-11008G19665
Show more names
1H-Benzimidazole-5-sulfonamide, 2,3-dihydro-1-methyl-2-thioxo-
1-methyl-2-thioxo-3H-benzimidazole-5-sulfonamideSR-01000058760SR-01000058760-1Z570325532,3-Dihydro-1-methyl-2-thioxo-1H-benzimidazole-5-sulfonamide1-Methyl-2-sulfanylidene-2,3-dihydro-1H-benzimidazole-5-sulfonamide
Database identifiers
- CAS
790271-20-4- PubChem CID
- 4868366
- DTXSID
DTXSID801183940
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 376
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers1 total
常州合晶化工有限公司85528066 13775048983 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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