Vitas-M small molecule compound
1-(2-chloro-4-fluorobenzyl)-4-isothiocyanato-3,5-dimethyl-1H-pyrazole
Catalog ID
STK312508
SMILES S=C=Nc1c(C)nn(c1C)Cc1ccc(cc1Cl)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C13H11ClFN3S MW 295.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11ClFN3S/c1-8-13(16-7-19)9(2)18(17-8)6-10-3-4-11(15)5-12(10)14/h3-5H,6H2,1-2H3InChIKey
NGAMAYRKUNYTSQ-UHFFFAOYSA-NSynonyms
1004193-38-71((2CHLORO4FLUOROPHENYL)METHYL)35DIMETHYLPYRAZOL4ISOTHIOCYANATE
1((2chloro4fluorophenyl)methyl)4isothiocyanato35dimethylpyrazole
1(2CHLORO4FLUOROBENZYL)4ISOTHIOCYANATO35
1(2chloro4fluorobenzyl)4isothiocyanato35dimethyl1Hpyrazole
1004193387
CC1=C(C(=NN1CC2=C(C=C(C=C2)F)Cl)C)N=C=S
InChI=1SC13H11ClFN3Sc1813(16719)9(2)18(178)6103411(15)512(10)14h35H6H212H3
MFCD04968724
ZINC000002536570
ZINC02536570
ZINC2536570
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