Vitas-M small molecule compound
4-[1-(2,4-dichlorobenzyl)-1H-pyrazol-4-yl]-5-(1-ethyl-1H-pyrazol-4-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL392269
SMILES CCn1ncc(c1)c1nnc(n1c1cnn(c1)Cc1ccc(cc1Cl)Cl)S
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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/c1-2-24-9-12(6-20-24)16-22-23-17(27)26(16)14-7-21-25(10-14)8-11-3-4-13(18)5-15(11)19/h3-7,9-10H,2,8H2,1H3,(H,23,27)InChIKey
WSYLFYXXGACNAJ-UHFFFAOYSA-NSynonyms
1005621-51-11005621511
4(1((24dichlorophenyl)methyl)pyrazol4yl)3(1ethylpyrazol4yl)1H124triazole5thione
4(1(24dichlorobenzyl)1Hpyrazol4yl)5(1ethyl1Hpyrazol4yl)4H124triazole3thiol
CCN1C=C(C=N1)C2=NNC(=S)N2C3=CN(N=C3)CC4=C(C=C(C=C4)Cl)Cl
InChI=1SC17H15Cl2N7Sc1224912(62024)16222317(27)26(16)1472125(1014)8113413(18)515(11)19h37910H28H21H3(H2327)
MFCD04059465
ZINC000002808786
ZINC02808786
ZINC2808786
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