Vitas-M small molecule compound
4-[(Z)-(5-imino-7-oxo-3-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]-2-methoxyphenyl 4-methylbenzenesulfonate
Catalog ID
STK712335
SMILES COc1cc(ccc1OS(=O)(=O)c1ccc(cc1)C)/C=C/1\C(=O)N=c2n(C1=N)c(cs2)c1ccccc1
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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 C27H21N3O5S2 MW 531.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N3O5S2/c1-17-8-11-20(12-9-17)37(32,33)35-23-13-10-18(15-24(23)34-2)14-21-25(28)30-22(19-6-4-3-5-7-19)16-36-27(30)29-26(21)31/h3-16,28H,1-2H3/b21-14-,28-25-InChIKey
WRAFDVDKJSMLEU-ZMSDRGEISA-NSynonyms
(Z)4((5imino7oxo3phenyl5Hthiazolo(32a)pyrimidin6(7H)ylidene)methyl)2methoxyphenyl4methylbenzenesulfonate
4((Z)(5imino7oxo3phenyl5H(13)thiazolo(32a)pyrimidin6(7H)ylidene)methyl)2methoxyphenyl4methylbenzenesulfonate
COc1cc(ccc1OS(=O)(=O)c1ccc(cc1)C)C=C1C(=O)N=c2n(C1=N)c(cs2)c1ccccc1
MFCD02988469
ZINC000100267664
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