Vitas-M small molecule compound
5-{5-[(4-tert-butylphenoxy)methyl]furan-2-yl}-4-(2-methylpropyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL177383
SMILES CC(Cn1c(S)nnc1c1ccc(o1)COc1ccc(cc1)C(C)(C)C)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 C21H27N3O2S MW 385.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O2S/c1-14(2)12-24-19(22-23-20(24)27)18-11-10-17(26-18)13-25-16-8-6-15(7-9-16)21(3,4)5/h6-11,14H,12-13H2,1-5H3,(H,23,27)InChIKey
DHQKYGQRCHTSFM-UHFFFAOYSA-NSynonyms
828290-31-93(5((4TERTBUTYLPHENOXY)METHYL)FURAN2YL)4(2METHYLPROPYL)1H124TRIAZOLE5THIONE
5(5((4tertbutylphenoxy)methyl)furan2yl)4(2methylpropyl)4H124triazole3thiol
828290319
CC(C)CN1C(=NNC1=S)C2=CC=C(O2)COC3=CC=C(C=C3)C(C)(C)C
InChI=1SC21H27N3O2Sc114(2)122419(222320(24)27)18111017(2618)1325168615(7916)21(34)5h61114H1213H215H3(H2327)
MFCD04053655
ZINC000002793165
ZINC02793165
ZINC2793165
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