Vitas-M small molecule compound
4-{(Z)-[5-imino-7-oxo-2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}-2-methoxyphenyl 2-chlorobenzoate
Catalog ID
STL239947
SMILES COc1cc(ccc1OC(=O)c1ccccc1Cl)/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 C25H16ClN5O4S MW 517.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H16ClN5O4S/c1-34-20-12-14(8-9-19(20)35-24(33)16-6-2-3-7-18(16)26)11-17-21(27)31-25(29-22(17)32)36-23(30-31)15-5-4-10-28-13-15/h2-13,27H,1H3/b17-11-,27-21-InChIKey
LCBWNFZGJBVINS-WLAOSPSWSA-NSynonyms
844450-61-9(Z)4((5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)2methoxyphenyl2chlorobenzoate
4((Z)(5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)2methoxyphenyl2chlorobenzoate
844450619
COc1cc(ccc1OC(=O)c1ccccc1Cl)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
MFCD04155872
ZINC000101093670
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