Vitas-M small molecule compound
4-{(E)-[2-({[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-2-methoxyphenolate
Catalog ID
STK563321
SMILES COc1ccc(cc1)n1c(SCC(=O)N/N=C/c2ccc(c(c2)OC)[O-])[nH+]nc1c1ccc(cc1)C(C)(C)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 C29H31N5O4S MW 545.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N5O4S/c1-29(2,3)21-9-7-20(8-10-21)27-32-33-28(34(27)22-11-13-23(37-4)14-12-22)39-18-26(36)31-30-17-19-6-15-24(35)25(16-19)38-5/h6-17,35H,18H2,1-5H3,(H,31,36)/b30-17+InChIKey
LIIHDEASOUUKHY-OCSSWDANSA-NSynonyms
488731-50-64((E)(2(((5(4tertbutylphenyl)4(4methoxyphenyl)4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)2methoxyphenolate
COc1ccc(cc1)n1c(SCC(=O)NN=Cc2ccc(c(c2)OC)(O))(nH+)nc1c1ccc(cc1)C(C)(C)C
MFCD03220073
ZINC000002338817
Check stock
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