Vitas-M small molecule compound
4-(tetrahydrofuran-2-ylmethyl)-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK448297
SMILES COc1cc(cc(c1OC)OC)c1nnc(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 C16H21N3O4S MW 351.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N3O4S/c1-20-12-7-10(8-13(21-2)14(12)22-3)15-17-18-16(24)19(15)9-11-5-4-6-23-11/h7-8,11H,4-6,9H2,1-3H3,(H,18,24)InChIKey
VWRCHQOBRLAGFB-UHFFFAOYSA-NSynonyms
4(oxolan2ylmethyl)3(345trimethoxyphenyl)1H124triazole5thione
4(OXOLAN2YLMETHYL)5(345TRIMETHOXYPHENYL)124TRIAZOLE3THIOL
4(tetrahydrofuran2ylmethyl)5(345trimethoxyphenyl)4H124triazole3thiol
COC1=CC(=CC(=C1OC)OC)C2=NNC(=S)N2CC3CCCO3
InChI=1SC16H21N3O4Sc12012710(813(212)14(12)223)15171816(24)19(15)9115462311h7811H469H213H3(H1824)
MFCD04140287
ZINC000006641489
ZINC000006641491
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