Vitas-M small molecule compound
4-methyl-5-[4-(propan-2-yloxy)benzyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK995867
SMILES CC(Oc1ccc(cc1)Cc1nnc(n1C)S)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 C13H17N3OS MW 263.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17N3OS/c1-9(2)17-11-6-4-10(5-7-11)8-12-14-15-13(18)16(12)3/h4-7,9H,8H2,1-3H3,(H,15,18)InChIKey
GTLMCZOKNMURPD-UHFFFAOYSA-NSynonyms
69198-29-44METHYL3((4PROPAN2YLOXYPHENYL)METHYL)1H124TRIAZOLE5THIONE
4methyl5(4(propan2yloxy)benzyl)4H124triazole3thiol
5(4ISOPROPOXYBENZYL)4METHYL4H(124)TRIAZOLE3THIOL
5(4ISOPROPOXYBENZYL)4METHYL4H124TRIAZOLE3THIOL
69198294
CC(C)OC1=CC=C(C=C1)CC2=NNC(=S)N2C
InChI=1SC13H17N3OSc19(2)17116410(5711)812141513(18)16(12)3h479H8H213H3(H1518)
MFCD01807119
ZINC000006493112
ZINC06493112
ZINC6493112
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