Vitas-M small molecule compound
4-[1-(4-methylbenzyl)-1H-pyrazol-4-yl]-5-(1-methyl-1H-pyrazol-4-yl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL402629
SMILES Cc1ccc(cc1)Cn1ncc(c1)n1c(S)nnc1c1cnn(c1)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 C17H17N7S MW 351.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N7S/c1-12-3-5-13(6-4-12)9-23-11-15(8-19-23)24-16(20-21-17(24)25)14-7-18-22(2)10-14/h3-8,10-11H,9H2,1-2H3,(H,21,25)InChIKey
WNVHHOVWEHDJIW-UHFFFAOYSA-NSynonyms
1005666-99-81005666998
4(1((4methylphenyl)methyl)pyrazol4yl)3(1methylpyrazol4yl)1H124triazole5thione
4(1(4methylbenzyl)1Hpyrazol4yl)5(1methyl1Hpyrazol4yl)4H124triazole3thiol
CC1=CC=C(C=C1)CN2C=C(C=N2)N3C(=NNC3=S)C4=CN(N=C4)C
InChI=1SC17H17N7Sc1123513(6412)9231115(81923)2416(202117(24)25)1471822(2)1014h381011H9H212H3(H2125)
MFCD04059384
ZINC000002808713
ZINC02808713
ZINC2808713
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