Basic information
- CAS
8017-57-0- Standard SMILES
Cc1cc(C)nc(NS(=O)(=O)c2ccc(N)cc2)n1.Cc1ccnc(NS(=O)(=O)c2ccc(N)cc2)n1.Nc1ccc(S(=O)(=O)Nc2ncccn2)cc1- InChIKey
CBQDCAAOUQVIJL-UHFFFAOYSA-N- Molecular formula
- C33H36N12O6S3
- Average molar mass
- 792.9 g/mol
- Monoisotopic mass
- 792.20429044
Overview
RN given refers to above drug combination; RR:65567-91-1 refers to Na salt of each of the components; contains above 3 cpds
Names & identifiers
- Preferred name
- Benzenesulfonamide, 4-amino-N-(4,6-dimethyl-2-pyrimidinyl)-, mixt. with 4-amino-N-(4-methyl-2-pyrimidinyl)benzenesulfonamide and 4-amino-N-2-pyrimidinylbenzenesulfonamide
- IUPAC
- 4-amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide;4-amino-N-(4-methylpyrimidin-2-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide
- English name
- trisulfapyrimidine
- Molecular formula
- C33H36N12O6S3
- Molecular weight
- 792.91
Names & synonyms
Trisulfapyrimidine8017-57-0DTXSID202301254-Amino-N-(4,6-dimethyl-2-pyrimidinyl)benzenesulfonamide, mixt. with 4-amino-N-(4-methyl-2-pyrimidinyl)benzenesulfonamide & 4-amino-N-2-pyrimidinylbenzenesulfonamideBenzenesulfonamide, 4-amino-N-(4,6-dimethyl-2-pyrimidinyl)-, mixt. with 4-amino-N-(4-methyl-2-pyrimidinyl)benzenesulfonamide and 4-amino-N-2-pyrimidinylbenzenesulfonamideRefChem:916892DTXCID20152616LantrisulSulfaloidSulfa-Triple #2TrisulfaSCHEMBL30306297
Show more names
4-amino-N-(4,6-dimethylpyrimidin-2-yl)benzenesulfonamide;4-amino-N-(4-methylpyrimidin-2-yl)benzenesulfonamide;4-amino-N-pyrimidin-2-ylbenzenesulfonamide
Database identifiers
- CAS
8017-57-0
Properties
Computed structural properties
- Topological polar surface area
- 319 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 18
- Rotatable bonds
- 9
- Heavy atoms
- 54
- Formal charge
- 0
- Complexity
- 1,060
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…