Vitas-M small molecule compound
5-(methoxymethyl)-4-[1-(4-methylbenzyl)-1H-pyrazol-4-yl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STL390682
SMILES COCc1nnc(n1c1cnn(c1)Cc1ccc(cc1)C)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 C15H17N5OS MW 315.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17N5OS/c1-11-3-5-12(6-4-11)8-19-9-13(7-16-19)20-14(10-21-2)17-18-15(20)22/h3-7,9H,8,10H2,1-2H3,(H,18,22)InChIKey
WWQMTVLJYGSNFB-UHFFFAOYSA-NSynonyms
1005675-34-21005675342
3(methoxymethyl)4(1((4methylphenyl)methyl)pyrazol4yl)1H124triazole5thione
5(methoxymethyl)4(1(4methylbenzyl)1Hpyrazol4yl)4H124triazole3thiol
CC1=CC=C(C=C1)CN2C=C(C=N2)N3C(=NNC3=S)COC
InChI=1SC15H17N5OSc1113512(6411)819913(71619)2014(10212)171815(20)22h379H810H212H3(H1822)
MFCD04137981
ZINC000002809478
ZINC02809478
ZINC2809478
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