Vitas-M small molecule compound
5-(4-ethoxybenzyl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK466138
SMILES CCOc1ccc(cc1)Cc1nnc(n1CC1CCCO1)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 C16H21N3O2S MW 319.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3O2S/c1-2-20-13-7-5-12(6-8-13)10-15-17-18-16(22)19(15)11-14-4-3-9-21-14/h5-8,14H,2-4,9-11H2,1H3,(H,18,22)InChIKey
NASFPDFIWZUXBG-UHFFFAOYSA-NSynonyms
3((4ethoxyphenyl)methyl)4(oxolan2ylmethyl)1H124triazole5thione
5((4ETHOXYPHENYL)METHYL)4(OXOLAN2YLMETHYL)124TRIAZOLE3THIOL
5(4ethoxybenzyl)4(tetrahydrofuran2ylmethyl)4H124triazole3thiol
CCOC1=CC=C(C=C1)CC2=NNC(=S)N2CC3CCCO3
InChI=1SC16H21N3O2Sc1220137512(6813)1015171816(22)19(15)11144392114h5814H24911H21H3(H1822)
MFCD06759394
ZINC000017055046
ZINC000017055049
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