Vitas-M small molecule compound
2,6-di-tert-butyl-4-{(E)-[2-({[5-(4-tert-butylphenyl)-4-phenyl-4H-1,2,4-triazol-2-ium-3-yl]sulfanyl}acetyl)hydrazinylidene]methyl}phenolate
Catalog ID
STK564692
SMILES O=C(CSc1[nH+]nc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)N/N=C/c1cc(c(c(c1)C(C)(C)C)[O-])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 C35H43N5O2S MW 597.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H43N5O2S/c1-33(2,3)25-17-15-24(16-18-25)31-38-39-32(40(31)26-13-11-10-12-14-26)43-22-29(41)37-36-21-23-19-27(34(4,5)6)30(42)28(20-23)35(7,8)9/h10-21,42H,22H2,1-9H3,(H,37,41)/b36-21+InChIKey
OOEHVWAZYKVYIH-QLQYKETESA-NSynonyms
1321940-79-71321940797
26ditertbutyl4((E)(2(((5(4tertbutylphenyl)4phenyl4H124triazol2ium3yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenolate
MFCD02641918
O=C(CSc1(nH+)nc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C)NN=Cc1cc(c(c(c1)C(C)(C)C)(O))C(C)(C)C
ZINC000002704895
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