Vitas-M small molecule compound
1-{(E)-[2-({[4-(4-chlorophenyl)-5-(4-methylphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}naphthalen-2-olate
Catalog ID
STL046014
SMILES O=C(CSc1[nH+]nc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)N/N=C/c1c([O-])ccc2c1cccc2
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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 C28H22ClN5O2S MW 528.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22ClN5O2S/c1-18-6-8-20(9-7-18)27-32-33-28(34(27)22-13-11-21(29)12-14-22)37-17-26(36)31-30-16-24-23-5-3-2-4-19(23)10-15-25(24)35/h2-16,35H,17H2,1H3,(H,31,36)/b30-16+InChIKey
GLNHABXUERYWHS-OKCVXOCRSA-NSynonyms
488101-15-11((E)(2(((4(4chlorophenyl)5(4methylphenyl)4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)naphthalen2olate
488101151
MFCD03220186
O=C(CSc1(nH+)nc(n1c1ccc(cc1)Cl)c1ccc(cc1)C)NN=Cc1c((O))ccc2c1cccc2
ZINC000002327224
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