Vitas-M small molecule compound
4-{(E)-[2-({[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2,6-dimethoxyphenolate
Catalog ID
STK561570
SMILES COc1cc(/C=N/NC(=O)CSc2[nH+]nc(n2CC)c2ccc(cc2)C(C)(C)C)cc(c1[O-])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 C25H31N5O4S MW 497.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N5O4S/c1-7-30-23(17-8-10-18(11-9-17)25(2,3)4)28-29-24(30)35-15-21(31)27-26-14-16-12-19(33-5)22(32)20(13-16)34-6/h8-14,32H,7,15H2,1-6H3,(H,27,31)/b26-14+InChIKey
WYQGOLFMIZRJLH-VULFUBBASA-NSynonyms
612811-09-34((E)(2(((5(4tertbutylphenyl)4ethyl4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)26dimethoxyphenolate
612811093
COc1cc(C=NNC(=O)CSc2(nH+)nc(n2CC)c2ccc(cc2)C(C)(C)C)cc(c1(O))OC
MFCD03219065
ZINC000001477795
Check stock
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