Vitas-M small molecule compound
(2Z)-3-{3-ethoxy-4-[(4-fluorobenzyl)oxy]phenyl}-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid
Catalog ID
STL505141
SMILES CCOc1cc(ccc1OCc1ccc(cc1)F)/C=C(/C(=O)O)\Sc1nnc([nH]1)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 C21H20FN3O4S MW 429.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20FN3O4S/c1-3-28-18-10-15(11-19(20(26)27)30-21-23-13(2)24-25-21)6-9-17(18)29-12-14-4-7-16(22)8-5-14/h4-11H,3,12H2,1-2H3,(H,26,27)(H,23,24,25)/b19-11-InChIKey
ILPVMVPQVSSWPV-ODLFYWEKSA-NSynonyms
843621-09-0(~(Z))3(3ethoxy4((4fluorophenyl)methoxy)phenyl)2((5methyl1~(H)124triazol3yl)sulfanyl)prop2enoicacid
(2Z)3(3ethoxy4((4fluorobenzyl)oxy)phenyl)2((5methyl4H124triazol3yl)sulfanyl)prop2enoicacid
(Z)3(3ethoxy4((4fluorobenzyl)oxy)phenyl)2((5methyl4H124triazol3yl)thio)acrylicacid
1399241
843621090
CCOc1cc(ccc1OCc1ccc(cc1)F)C=C(C(=O)O)Sc1nnc((nH)1)C
MFCD04015432
ZINC000009359209
Check stock
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Check stock on Vitas-MAvailable files
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