Vitas-M small molecule compound
2-{(E)-[2-({[4,5-bis(4-methoxyphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-6-methoxyphenolate
Catalog ID
STL148333
SMILES COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2cccc(c2[O-])OC)[nH+]nc1c1ccc(cc1)OC
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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 C26H25N5O5S MW 519.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O5S/c1-34-20-11-7-17(8-12-20)25-29-30-26(31(25)19-9-13-21(35-2)14-10-19)37-16-23(32)28-27-15-18-5-4-6-22(36-3)24(18)33/h4-15,33H,16H2,1-3H3,(H,28,32)/b27-15+InChIKey
VATNZIVSSOUUIU-JFLMPSFJSA-NSynonyms
406202-81-12((E)(2(((45bis(4methoxyphenyl)4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)6methoxyphenolate
406202811
COc1ccc(cc1)n1c(SCC(=O)NN=Cc2cccc(c2(O))OC)(nH+)nc1c1ccc(cc1)OC
MFCD03220750
ZINC000001474612
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