Vitas-M small molecule compound
4-{(E)-[5-imino-7-oxo-2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}-2-methoxyphenyl methanesulfonate
Catalog ID
STL234689
SMILES COc1cc(ccc1OS(=O)(=O)C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)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 C19H15N5O5S2 MW 457.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N5O5S2/c1-28-15-9-11(5-6-14(15)29-31(2,26)27)8-13-16(20)24-19(22-17(13)25)30-18(23-24)12-4-3-7-21-10-12/h3-10,20H,1-2H3/b13-8+,20-16-InChIKey
UTWFRXBITZFWEW-RCUCZINOSA-NSynonyms
844829-20-5(E)4((5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)2methoxyphenylmethanesulfonate
4((E)(5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)2methoxyphenylmethanesulfonate
844829205
COc1cc(ccc1OS(=O)(=O)C)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
MFCD04161594
ZINC000006144814
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