chempirical

Thifensulfuron

C11H11N5O6S2CAS 79277-67-1373.36 g/mol

Open in Covalent MOL file
ONNNONHSOOSOOHHN
Carboxylic acidEther

Properties

Molecular formula
C11H11N5O6S2
Molar mass
373.36 g/mol
Exact mass
373.0151 Da
logP
0.09Crippen estimate
Polar surface area
167.2 Ų
H-bond donors / acceptors
3 / 7
Rotatable bonds
4

Identifiers

CAS number
79277-67-1
SMILES
COc1nc(C)nc(=NC(O)=NS(=O)(=O)c2ccsc2C(=O)O)[nH]1
InChIKey
LOQQVLXUKHKNIA-UHFFFAOYSA-N
InChI
InChI=1S/C11H11N5O6S2/c1-5-12-9(15-11(13-5)22-2)14-10(19)16-24(20,21)6-3-4-23-7(6)8(17)18/h3-4H,1-2H3,(H,17,18)(H2,12,13,14,15,16,19)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • 2-Thiophenecarboxylic acid, 3-[[[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]amino]sulfonyl]-
  • 3-[[[[(4-Methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]amino]sulfonyl]-2-thiophenecarboxylic acid
  • Thiameturon
  • L 9225
  • Pinnacle SG

Work with Thifensulfuron

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Thifensulfuron methyl79277-27-381 % similar Chlorsulfuron64902-72-364 % similar Metsulfuron-methyl74223-64-662 % similar Triasulfuron82097-50-558 % similar Prosulfuron94125-34-558 % similar Cinosulfuron94593-91-642 % similar Tribenuron106040-48-637 % similar Iodosulfuron methyl ester sodium salt144550-36-737 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook