Vitas-M small molecule compound
4-[(E)-{[3-sulfanyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-4-yl]imino}methyl]benzene-1,2-diol
Catalog ID
STL334961
SMILES COc1c(OC)cc(cc1OC)c1nnc(n1/N=C/c1ccc(c(c1)O)O)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 C18H18N4O5S MW 402.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O5S/c1-25-14-7-11(8-15(26-2)16(14)27-3)17-20-21-18(28)22(17)19-9-10-4-5-12(23)13(24)6-10/h4-9,23-24H,1-3H3,(H,21,28)/b19-9+InChIKey
BYONSXOKVNWUAS-DJKKODMXSA-NSynonyms
496772-19-1(E)4(((3mercapto5(345trimethoxyphenyl)4H124triazol4yl)imino)methyl)benzene12diol
4((E)((3sulfanyl5(345trimethoxyphenyl)4H124triazol4yl)imino)methyl)benzene12diol
496772191
COc1c(OC)cc(cc1OC)c1nnc(n1N=Cc1ccc(c(c1)O)O)S
MFCD03222300
ZINC000005795164
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