Vitas-M small molecule compound
(2Z)-3-(2-ethoxy-3-methoxyphenyl)-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid
Catalog ID
STL505916
SMILES CCOc1c(cccc1OC)/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 C15H17N3O4S MW 335.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17N3O4S/c1-4-22-13-10(6-5-7-11(13)21-3)8-12(14(19)20)23-15-16-9(2)17-18-15/h5-8H,4H2,1-3H3,(H,19,20)(H,16,17,18)/b12-8-InChIKey
RMDVZJZPZBGSFF-WQLSENKSSA-NSynonyms
(~(Z))3(2ethoxy3methoxyphenyl)2((5methyl1~(H)124triazol3yl)sulfanyl)prop2enoicacid
(2Z)3(2ethoxy3methoxyphenyl)2((5methyl4H124triazol3yl)sulfanyl)prop2enoicacid
936508
InChI=1SC15H17N3O4Sc14221310(65711(13)213)812(14(19)20)2315169(2)171815h58H4H213H3(H1920)(H161718)b128
MFCD04326700
ZINC000005906019
ZINC5906019
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