Vitas-M small molecule compound
4-[1-(2,4-dichlorobenzyl)-1H-pyrazol-4-yl]-5-(1,3-dimethyl-1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL400586
SMILES Clc1ccc(c(c1)Cl)Cn1ncc(c1)n1c(S)nnc1c1cc(nn1C)C
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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 C17H15Cl2N7S MW 420.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15Cl2N7S/c1-10-5-15(24(2)23-10)16-21-22-17(27)26(16)13-7-20-25(9-13)8-11-3-4-12(18)6-14(11)19/h3-7,9H,8H2,1-2H3,(H,22,27)InChIKey
UDNFSZHGYAGKIT-UHFFFAOYSA-NSynonyms
1005706-77-31005706773
4(1((24dichlorophenyl)methyl)pyrazol4yl)3(25dimethylpyrazol3yl)1H124triazole5thione
4(1(24dichlorobenzyl)1Hpyrazol4yl)5(13dimethyl1Hpyrazol5yl)4H124triazole3thiol
CC1=NN(C(=C1)C2=NNC(=S)N2C3=CN(N=C3)CC4=C(C=C(C=C4)Cl)Cl)C
InChI=1SC17H15Cl2N7Sc110515(24(2)2310)16212217(27)26(16)1372025(913)8113412(18)614(11)19h379H8H212H3(H2227)
MFCD04058887
ZINC000002808255
ZINC02808255
ZINC2808255
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