Basic information
- CAS
19918-49-1- Standard SMILES
CCCCc1nnc(NS(=O)(=O)c2ccc(C)cc2)s1- InChIKey
OFWASDFJBMOHBA-UHFFFAOYSA-N- Molecular formula
- C13H17N3O2S2
- Average molar mass
- 311.4 g/mol
- Monoisotopic mass
- 311.07621914
Names & identifiers
- Preferred name
- n-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide
- IUPAC
- N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamide
- English name
- N-(5-Butyl-1,3,4-thiadiazol-2-yl)-p-toluenesulfonamide
- Molecular formula
- C13H17N3O2S2
- Molecular weight
- 311.42
Names & synonyms
19918-49-1n-(5-butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzenesulfonamideNSC97572SCHEMBL10555986DTXSID30941831N-(5-Butyl-1,3,4-thiadiazol-2-yl)-4-methylbenzene-1-sulfonamideNSC-97572N-(5-Butyl-1,3,4-thiadiazol-2-yl)-p-toluenesulfonamideBenzenesulfonamide, N-(5-butyl-1,3,4-thiadiazol-2-yl)-4-methyl-
Database identifiers
- CAS
19918-49-1- PubChem CID
- 263197
- DTXSID
DTXSID30941831- Nikkaji
- J307.735G
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 389
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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