Vitas-M small molecule compound
1-{(E)-[2-({[4,5-bis(4-methoxyphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}naphthalen-2-olate
Catalog ID
STK565248
SMILES COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2c([O-])ccc3c2cccc3)[nH+]nc1c1ccc(cc1)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 C29H25N5O4S MW 539.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N5O4S/c1-37-22-12-7-20(8-13-22)28-32-33-29(34(28)21-10-14-23(38-2)15-11-21)39-18-27(36)31-30-17-25-24-6-4-3-5-19(24)9-16-26(25)35/h3-17,35H,18H2,1-2H3,(H,31,36)/b30-17+InChIKey
VJKCEPRYONVIBP-OCSSWDANSA-NSynonyms
406203-32-51((E)(2(((45bis(4methoxyphenyl)4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)naphthalen2olate
406203325
COc1ccc(cc1)n1c(SCC(=O)NN=Cc2c((O))ccc3c2cccc3)(nH+)nc1c1ccc(cc1)OC
MFCD03220714
ZINC000002321153
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