Vitas-M small molecule compound
2-chloro-4-{(Z)-[5-imino-7-oxo-2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}phenyl benzenesulfonate
Catalog ID
STL236671
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1ccc(c(c1)Cl)OS(=O)(=O)c1ccccc1)c1cccnc1
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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 C23H14ClN5O4S2 MW 523.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H14ClN5O4S2/c24-18-12-14(8-9-19(18)33-35(31,32)16-6-2-1-3-7-16)11-17-20(25)29-23(27-21(17)30)34-22(28-29)15-5-4-10-26-13-15/h1-13,25H/b17-11-,25-20-InChIKey
LNPGNOMCTDCNJF-WKLGKFTISA-NSynonyms
861638-42-8(Z)2chloro4((5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenylbenzenesulfonate
2chloro4((Z)(5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenylbenzenesulfonate
861638428
MFCD05685604
O=C1N=c2sc(nn2C(=N)C1=Cc1ccc(c(c1)Cl)OS(=O)(=O)c1ccccc1)c1cccnc1
ZINC000101204559
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