Vitas-M small molecule compound
4-bromo-2-{(E)-[2-({[5-(4-tert-butylphenyl)-4-ethyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenolate
Catalog ID
STL151071
SMILES CCn1c(SCC(=O)N/N=C/c2cc(Br)ccc2[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 C23H26BrN5O2S MW 516.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26BrN5O2S/c1-5-29-21(15-6-8-17(9-7-15)23(2,3)4)27-28-22(29)32-14-20(31)26-25-13-16-12-18(24)10-11-19(16)30/h6-13,30H,5,14H2,1-4H3,(H,26,31)/b25-13+InChIKey
ACANORBYYFBLSR-DHRITJCHSA-NSynonyms
497822-18-1497822181
4bromo2((E)(2(((5(4tertbutylphenyl)4ethyl4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenolate
CCn1c(SCC(=O)NN=Cc2cc(Br)ccc2(O))(nH+)nc1c1ccc(cc1)C(C)(C)C
MFCD03219161
ZINC000002350058
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