5-[(4-chloro-2,5-dimethyl-phenyl)sulfanylmethyl]-2,4-dihydropyrazol-3-one
Molecular Formula:
C
12
H
13
ClN
2
OS
InChI:
InChI=1/C12H13ClN2OS/c1-7-4-11(8(2)3-10(7)13)17-6-9-5-12(16)15-14-9/h3-4H,5-6H2,1-2H3,(H,15,16)/f/h15H
InChIKey:
InChIKey=WFZBBSATHPPYIJ-YAQRNVERCI
SMILES:
CC1=CC(=C(C=C1Cl)C)SCC2=NNC(=O)C2
Names:
5-[(4-chloro-2,5-dimethyl-phenyl)sulfanylmethyl]-2,4-dihydropyrazol-3-one
Registries:
PubChem CID 2799645
PubChem ID 3255961