Vitas-M small molecule compound
4-[1-(4-methylbenzyl)-1H-pyrazol-4-yl]-5-(1H-pyrazol-1-ylmethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL399919
SMILES Cc1ccc(cc1)Cn1ncc(c1)n1c(S)nnc1Cn1cccn1
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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 C17H17N7S MW 351.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N7S/c1-13-3-5-14(6-4-13)10-23-11-15(9-19-23)24-16(20-21-17(24)25)12-22-8-2-7-18-22/h2-9,11H,10,12H2,1H3,(H,21,25)InChIKey
ZBZATFKQSIMKOV-UHFFFAOYSA-NSynonyms
1005646-71-81005646718
4(1((4methylphenyl)methyl)pyrazol4yl)3(pyrazol1ylmethyl)1H124triazole5thione
4(1(4METHYLBENZYL)1HPYRAZOL4YL)5(1HPYRAZOL1YLMETHYL)4H124TRIAZOLE3THIOL
CC1=CC=C(C=C1)CN2C=C(C=N2)N3C(=NNC3=S)CN4C=CC=N4
InChI=1SC17H17N7Sc1133514(6413)10231115(91923)2416(202117(24)25)12228271822h2911H1012H21H3(H2125)
MFCD04138264
ZINC000002809752
ZINC02809752
ZINC2809752
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