Vitas-M small molecule compound
5-(4-chloro-1-ethyl-1H-pyrazol-3-yl)-4-[1-(4-methylbenzyl)-1H-pyrazol-4-yl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK311479
SMILES CCn1cc(c(n1)c1nnc(n1c1cnn(c1)Cc1ccc(cc1)C)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 C18H18ClN7S MW 399.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN7S/c1-3-24-11-15(19)16(23-24)17-21-22-18(27)26(17)14-8-20-25(10-14)9-13-6-4-12(2)5-7-13/h4-8,10-11H,3,9H2,1-2H3,(H,22,27)InChIKey
QMPGREYGRIEFBV-UHFFFAOYSA-NSynonyms
1005671-52-21005671522
3(4chloro1ethylpyrazol3yl)4(1((4methylphenyl)methyl)pyrazol4yl)1H124triazole5thione
5(4chloro1ethyl1Hpyrazol3yl)4(1(4methylbenzyl)1Hpyrazol4yl)4H124triazole3thiol
CCN1C=C(C(=N1)C2=NNC(=S)N2C3=CN(N=C3)CC4=CC=C(C=C4)C)Cl
InChI=1SC18H18ClN7Sc13241115(19)16(2324)17212218(27)26(17)1482025(1014)9136412(2)5713h481011H39H212H3(H2227)
MFCD04137999
ZINC000002809493
ZINC02809493
ZINC2809493
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