Vitas-M small molecule compound
4-{(1Z)-1-[2-({[5-(4-chlorophenyl)-4-cyclohexyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]ethyl}-2-methoxyphenolate
Catalog ID
STL149335
SMILES COc1cc(ccc1[O-])/C(=N\NC(=O)CSc1[nH+]nc(n1C1CCCCC1)c1ccc(cc1)Cl)/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 C25H28ClN5O3S MW 514.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28ClN5O3S/c1-16(18-10-13-21(32)22(14-18)34-2)27-28-23(33)15-35-25-30-29-24(17-8-11-19(26)12-9-17)31(25)20-6-4-3-5-7-20/h8-14,20,32H,3-7,15H2,1-2H3,(H,28,33)/b27-16-InChIKey
JUAJRYFCKJJJEJ-YUMHPJSZSA-NSynonyms
488109-70-24((1Z)1(2(((5(4chlorophenyl)4cyclohexyl4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)ethyl)2methoxyphenolate
488109702
COc1cc(ccc1(O))C(=NNC(=O)CSc1(nH+)nc(n1C1CCCCC1)c1ccc(cc1)Cl)C
MFCD03289051
ZINC000013563605
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