955976-96-2
N-((5-CHLORO-1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOL-4-YL)METHYL)-N-(4-METHOXYPHENYL)BENZENESULFONAMIDE
NameN-((5-CHLORO-1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOL-4-YL)METHYL)-N-(4-METHOXYPHENYL)BENZENESULFONAMIDE
FormulaC19 H17 Cl F3 N3 O3 S
1Identification
【Name】
N-((5-CHLORO-1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOL-4-YL)METHYL)-N-(4-METHOXYPHENYL)BENZENESULFONAMIDE
【CAS】
【MDL】
MFCD03012521
【English Synonyms】
【Formula】
C19 H17 Cl F3 N3 O3 S
【MolWeight】
459.874
【Inchi】
InChI=1S/C19H17ClF3N3O3S/c1-25-18(20)16(17(24-25)19(21,22)23)12-26(13-8-10-14(29-2)11-9-13)30(27,28)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3
【InChIKey】
InChIKey=OFSBFCPWCJCQJI-UHFFFAOYSA-N
【SMILES】
Cn1c(c(c(n1)C(F)(F)F)CN(c2ccc(cc2)OC)S(=O)(=O)c3ccccc3)Cl
【MOL File】
N-((5-CHLORO-1-METHY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-((5-CHLORO-1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOL-4-YL)METHYL)-N-(4-METHOXYPHENYL)BENZENESULFONAMIDE.cml