Vitas-M small molecule compound
2-({4-[(E)-(5-imino-7-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]-2-iodo-6-methoxyphenoxy}methyl)benzonitrile
Catalog ID
STK017935
SMILES CCCc1sc2=NC(=O)/C(=C/c3cc(I)c(c(c3)OC)OCc3ccccc3C#N)/C(=N)n2n1
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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 C24H20IN5O3S MW 585.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20IN5O3S/c1-3-6-20-29-30-22(27)17(23(31)28-24(30)34-20)9-14-10-18(25)21(19(11-14)32-2)33-13-16-8-5-4-7-15(16)12-26/h4-5,7-11,27H,3,6,13H2,1-2H3/b17-9+,27-22+InChIKey
FORPFITWODUXSC-OSOZYMOOSA-NSynonyms
2((4((E)(5imino7oxo2propyl5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)2iodo6methoxyphenoxy)methyl)benzonitrile
CCCc1sc2=NC(=O)C(=Cc3cc(I)c(c(c3)OC)OCc3ccccc3C#N)C(=N)n2n1
MFCD03227332
STK017935
ZINC000097957986
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