Vitas-M small molecule compound
1-(2,4-dichlorobenzyl)-4-isothiocyanato-3,5-dimethyl-1H-pyrazole
Catalog ID
STK312926
SMILES S=C=Nc1c(C)nn(c1C)Cc1ccc(cc1Cl)Cl
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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 C13H11Cl2N3S MW 312.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11Cl2N3S/c1-8-13(16-7-19)9(2)18(17-8)6-10-3-4-11(14)5-12(10)15/h3-5H,6H2,1-2H3InChIKey
WDIAOWWVZSSAEU-UHFFFAOYSA-NSynonyms
1004193-43-41((24DICHLOROPHENYL)METHYL)35DIMETHYLPYRAZOL4ISOTHIOCYANATE
1((24dichlorophenyl)methyl)4isothiocyanato35dimethylpyrazole
1(24DICHLOROBENZYL)4ISOTHIOCYANATO35
1(24dichlorobenzyl)4isothiocyanato35dimethyl1Hpyrazole
1004193434
CC1=C(C(=NN1CC2=C(C=C(C=C2)Cl)Cl)C)N=C=S
InChI=1SC13H11Cl2N3Sc1813(16719)9(2)18(178)6103411(14)512(10)15h35H6H212H3
MFCD04968735
ZINC000002536581
ZINC02536581
ZINC2536581
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