Vitas-M small molecule compound
2-{(E)-[2-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-6-methoxyphenolate
Catalog ID
STL037205
SMILES CCn1c(SCC(=O)N/N=C/c2cccc(c2[O-])OC)[nH+]nc1c1ccc(cc1)Cl
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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 C20H20ClN5O3S MW 445.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN5O3S/c1-3-26-19(13-7-9-15(21)10-8-13)24-25-20(26)30-12-17(27)23-22-11-14-5-4-6-16(29-2)18(14)28/h4-11,28H,3,12H2,1-2H3,(H,23,27)/b22-11+InChIKey
KNTAXJCFQPZWLP-SSDVNMTOSA-NSynonyms
488122-05-02((E)(2(((5(4chlorophenyl)4ethyl4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)6methoxyphenolate
488122050
CCn1c(SCC(=O)NN=Cc2cccc(c2(O))OC)(nH+)nc1c1ccc(cc1)Cl
MFCD02022349
ZINC000001473946
Check stock
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