Vitas-M small molecule compound

2,6-di-tert-butyl-4-[(E)-(2-{[(1-ethyl-1H-3,1-benzimidazol-3-ium-2-yl)sulfanyl]acetyl}hydrazinylidene)methyl]phenolate

Catalog ID
STL044594
SMILES CCn1c(SCC(=O)N/N=C/c2cc(c(c(c2)C(C)(C)C)[O-])C(C)(C)C)[nH+]c2c1cccc2

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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 C26H34N4O2S MW 466.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N4O2S/c1-8-30-21-12-10-9-11-20(21)28-24(30)33-16-22(31)29-27-15-17-13-18(25(2,3)4)23(32)19(14-17)26(5,6)7/h9-15,32H,8,16H2,1-7H3,(H,29,31)/b27-15+
InChIKey
KOOPMZHBLVZYKN-JFLMPSFJSA-N
Synonyms
306953-49-1
26ditertbutyl4((E)(2(((1ethyl1H31benzimidazol3ium2yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenolate
306953491
CCn1c(SCC(=O)NN=Cc2cc(c(c(c2)C(C)(C)C)(O))C(C)(C)C)(nH+)c2c1cccc2
MFCD01842151

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Available files

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