Vitas-M small molecule compound
2-bromo-4-{(E)-[2-({[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}-6-methoxyphenolate
Catalog ID
STL149783
SMILES CCn1c(SCC(=O)N/N=C/c2cc(Br)c(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 C24H28BrN5O3S MW 546.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28BrN5O3S/c1-6-30-22(16-7-9-17(10-8-16)24(2,3)4)28-29-23(30)34-14-20(31)27-26-13-15-11-18(25)21(32)19(12-15)33-5/h7-13,32H,6,14H2,1-5H3,(H,27,31)/b26-13+InChIKey
GNSPRWIRDXRMDP-LGJNPRDNSA-NSynonyms
612811-02-62bromo4((E)(2(((5(4tertbutylphenyl)4ethyl4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)6methoxyphenolate
612811026
CCn1c(SCC(=O)NN=Cc2cc(Br)c(c(c2)OC)(O))(nH+)nc1c1ccc(cc1)C(C)(C)C
MFCD03679653
ZINC000002228836
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