Vitas-M small molecule compound
5-(3-methoxyphenyl)-4-(2-methylpropyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL182254
SMILES COc1cccc(c1)c1nnc(n1CC(C)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 C13H17N3OS MW 263.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3OS/c1-9(2)8-16-12(14-15-13(16)18)10-5-4-6-11(7-10)17-3/h4-7,9H,8H2,1-3H3,(H,15,18)InChIKey
HWKNPFRCWBEXQL-UHFFFAOYSA-NSynonyms
946757-96-63(3methoxyphenyl)4(2methylpropyl)1H124triazole5thione
5(3methoxyphenyl)4(2methylpropyl)4H124triazole3thiol
946757966
CC(C)CN1C(=NNC1=S)C2=CC(=CC=C2)OC
InChI=1SC13H17N3OSc19(2)81612(141513(16)18)1054611(710)173h479H8H213H3(H1518)
MFCD17011545
ZINC000009927974
ZINC9927974
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