Vitas-M small molecule compound

2,4-diiodo-6-[(E)-{[5-sulfanyl-3-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazol-1-ium-4-yl]imino}methyl]phenolate

Catalog ID
STK560032
SMILES COc1c(OC)cc(cc1OC)c1n[nH+]c(n1/N=C/c1cc(I)cc(c1[O-])I)S

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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 C18H16I2N4O4S MW 638.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16I2N4O4S/c1-26-13-5-9(6-14(27-2)16(13)28-3)17-22-23-18(29)24(17)21-8-10-4-11(19)7-12(20)15(10)25/h4-8,25H,1-3H3,(H,23,29)/b21-8+
InChIKey
NQRZKKBFPPSEKA-ODCIPOBUSA-N
Synonyms

24diiodo6((E)((5sulfanyl3(345trimethoxyphenyl)4H124triazol1ium4yl)imino)methyl)phenolate
COc1c(OC)cc(cc1OC)c1n(nH+)c(n1N=Cc1cc(I)cc(c1(O))I)S
MFCD03222310
ZINC000150407512

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Available files

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