chempirical

Chlorsulfuron

C12H12ClN5O4SCAS 64902-72-3357.77 g/mol

Open in Covalent MOL file
ONNNONHSOOClHN
Aryl halideEther

Properties

Molecular formula
C12H12ClN5O4S
Molar mass
357.77 g/mol
Exact mass
357.0299 Da
Melting point
174–178 °C
logP
0.98Crippen estimate
Polar surface area
129.9 Ų
H-bond donors / acceptors
2 / 5
Rotatable bonds
3

Identifiers

CAS number
64902-72-3
SMILES
COc1nc(C)nc(=NC(O)=NS(=O)(=O)c2ccccc2Cl)[nH]1
InChIKey
VJYIFXVZLXQVHO-UHFFFAOYSA-N
InChI
InChI=1S/C12H12ClN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19)

Weigh it out

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

Names and synonyms

16 names · show all
  • Benzenesulfonamide, 2-chloro-N-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]-
  • 2-Chloro-N-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]benzenesulfonamide
  • DPX 4189
  • Glean
  • Glean 20DF
  • DPX-W 4189
  • W 4189
  • Tuligen
  • N-(2-Chlorophenyl)sulfonyl-N′-(4-methyl-6-methoxy-2-triazinyl)urea
  • Khardin
  • Glean 75DF
  • Glean 75
  • Kartes
  • Kortes
  • Luhuanglong
  • Glean XP

Work with Chlorsulfuron

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

Triasulfuron82097-50-572 % similar Metsulfuron-methyl74223-64-671 % similar Prosulfuron94125-34-568 % similar Thifensulfuron79277-67-164 % similar Thifensulfuron methyl79277-27-362 % similar Cinosulfuron94593-91-651 % similar 4-Methoxy-N,6-dimethyl-1,3,5-triazin-2-amine5248-39-539 % similar Iodosulfuron methyl ester sodium salt144550-36-739 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia