Vitas-M small molecule compound
(2Z)-3-(2-methoxyphenyl)-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid
Catalog ID
STL505119
SMILES COc1ccccc1/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 C13H13N3O3S MW 291.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O3S/c1-8-14-13(16-15-8)20-11(12(17)18)7-9-5-3-4-6-10(9)19-2/h3-7H,1-2H3,(H,17,18)(H,14,15,16)/b11-7-InChIKey
OXATXEXWROVPOY-XFFZJAGNSA-NSynonyms
578746-73-3(~(Z))3(2methoxyphenyl)2((5methyl1~(H)124triazol3yl)sulfanyl)prop2enoicacid
(2Z)3(2methoxyphenyl)2((5methyl4H124triazol3yl)sulfanyl)prop2enoicacid
(Z)3(2METHOXYPHENYL)2((5METHYL1H124TRIAZOL3YL)SULFANYL)PROP2ENOICACID
(Z)3(2methoxyphenyl)2((5methyl4H124triazol3yl)thio)acrylicacid
1623102
578746733
COc1ccccc1C=C(C(=O)O)Sc1nnc((nH)1)C
InChI=1SC13H13N3O3Sc181413(16158)2011(12(17)18)79534610(9)192h37H12H3(H1718)(H141516)b117
MFCD04024164
ZINC000005072363
ZINC5072363
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