Vitas-M small molecule compound
4-(1-benzyl-1H-pyrazol-4-yl)-5-(4-chloro-1-ethyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL401732
SMILES CCn1cc(c(n1)c1nnc(n1c1cnn(c1)Cc1ccccc1)S)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 C17H16ClN7S MW 385.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16ClN7S/c1-2-23-11-14(18)15(22-23)16-20-21-17(26)25(16)13-8-19-24(10-13)9-12-6-4-3-5-7-12/h3-8,10-11H,2,9H2,1H3,(H,21,26)InChIKey
CTPPZGBJSDEWPE-UHFFFAOYSA-NSynonyms
1005669-61-31005669613
4(1benzyl1Hpyrazol4yl)5(4chloro1ethyl1Hpyrazol3yl)4H124triazole3thiol
4(1benzylpyrazol4yl)3(4chloro1ethylpyrazol3yl)1H124triazole5thione
CCN1C=C(C(=N1)C2=NNC(=S)N2C3=CN(N=C3)CC4=CC=CC=C4)Cl
InChI=1SC17H16ClN7Sc12231114(18)15(2223)16202117(26)25(16)1381924(1013)9126435712h381011H29H21H3(H2126)
MFCD04137706
ZINC000002809197
ZINC02809197
ZINC2809197
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