Vitas-M small molecule compound
4-[1-(2,6-dichlorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-5-(1-methyl-1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK311765
SMILES Sc1nnc(n1c1c(C)nn(c1C)Cc1c(Cl)cccc1Cl)c1ccnn1C
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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 C18H17Cl2N7S MW 434.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17Cl2N7S/c1-10-16(27-17(22-23-18(27)28)15-7-8-21-25(15)3)11(2)26(24-10)9-12-13(19)5-4-6-14(12)20/h4-8H,9H2,1-3H3,(H,23,28)InChIKey
MHORIRQVERAYDV-UHFFFAOYSA-NSynonyms
1005694-81-41005694814
4(1((26dichlorophenyl)methyl)35dimethylpyrazol4yl)3(2methylpyrazol3yl)1H124triazole5thione
4(1(26dichlorobenzyl)35dimethyl1Hpyrazol4yl)5(1methyl1Hpyrazol5yl)4H124triazole3thiol
CC1=C(C(=NN1CC2=C(C=CC=C2Cl)Cl)C)N3C(=NNC3=S)C4=CC=NN4C
InChI=1SC18H17Cl2N7Sc11016(2717(222318(27)28)15782125(15)3)11(2)26(2410)91213(19)54614(12)20h48H9H213H3(H2328)
MFCD04139968
ZINC000002730743
ZINC02730743
ZINC2730743
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