Vitas-M small molecule compound
4-{(E)-[2-({[5-(4-chlorophenyl)-4-ethyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenolate
Catalog ID
STL148645
SMILES CCn1c(SCC(=O)N/N=C/c2ccc(c(c2)OC)[O-])[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(14-5-7-15(21)8-6-14)24-25-20(26)30-12-18(28)23-22-11-13-4-9-16(27)17(10-13)29-2/h4-11,27H,3,12H2,1-2H3,(H,23,28)/b22-11+InChIKey
FGKQIBSYBZRCEV-SSDVNMTOSA-NSynonyms
488718-53-24((E)(2(((5(4chlorophenyl)4ethyl4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)2methoxyphenolate
488718532
CCn1c(SCC(=O)NN=Cc2ccc(c(c2)OC)(O))(nH+)nc1c1ccc(cc1)Cl
MFCD02022425
ZINC000009019759
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