Vitas-M small molecule compound

1-(2,6-dichlorobenzyl)-4-isothiocyanato-3,5-dimethyl-1H-pyrazole

Catalog ID
STK313267
SMILES S=C=Nc1c(C)nn(c1C)Cc1c(Cl)cccc1Cl

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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)6-10-11(14)4-3-5-12(10)15/h3-5H,6H2,1-2H3
InChIKey
UWFRWFSXPIFLBC-UHFFFAOYSA-N
Synonyms
1004193-58-1
1((26DICHLOROPHENYL)METHYL)35DIMETHYLPYRAZOL4ISOTHIOCYANATE
1((26dichlorophenyl)methyl)4isothiocyanato35dimethylpyrazole
1(26DICHLOROBENZYL)4ISOTHIOCYANATO35
1(26dichlorobenzyl)4isothiocyanato35dimethyl1Hpyrazole
1004193581
CC1=C(C(=NN1CC2=C(C=CC=C2Cl)Cl)C)N=C=S
InChI=1SC13H11Cl2N3Sc1813(16719)9(2)18(178)61011(14)43512(10)15h35H6H212H3
MFCD04968752
ZINC000002536598
ZINC02536598
ZINC2536598

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Available files

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