Vitas-M small molecule compound
5-{5-[(4-ethoxyphenoxy)methyl]furan-2-yl}-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK306668
SMILES CCOc1ccc(cc1)OCc1ccc(o1)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 C20H23N3O4S MW 401.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23N3O4S/c1-2-24-14-5-7-15(8-6-14)26-13-17-9-10-18(27-17)19-21-22-20(28)23(19)12-16-4-3-11-25-16/h5-10,16H,2-4,11-13H2,1H3,(H,22,28)InChIKey
GYYFPDLGOCOBIM-UHFFFAOYSA-NSynonyms
828282-17-33(5((4ETHOXYPHENOXY)METHYL)FURAN2YL)4(OXOLAN2YLMETHYL)1H124TRIAZOLE5THIONE
5(5((4ethoxyphenoxy)methyl)furan2yl)4(tetrahydrofuran2ylmethyl)4H124triazole3thiol
828282173
CCOC1=CC=C(C=C1)OCC2=CC=C(O2)C3=NNC(=S)N3CC4CCCO4
InChI=1SC20H23N3O4Sc1224145715(8614)26131791018(2717)19212220(28)23(19)121643112516h51016H241113H21H3(H2228)
MFCD04053635
ZINC000008324357
ZINC000008324361
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