Vitas-M small molecule compound
methyl (2Z)-2-(2-fluorobenzylidene)-5-[3-methoxy-4-(prop-2-en-1-yloxy)phenyl]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK811638
SMILES C=CCOc1ccc(cc1OC)C1C(=C(C)N=c2n1c(=O)/c(=C/c1ccccc1F)/s2)C(=O)OC
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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 C26H23FN2O5S MW 494.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23FN2O5S/c1-5-12-34-19-11-10-17(13-20(19)32-3)23-22(25(31)33-4)15(2)28-26-29(23)24(30)21(35-26)14-16-8-6-7-9-18(16)27/h5-11,13-14,23H,1,12H2,2-4H3/b21-14-InChIKey
GWRQBYBQFPWDCO-STZFKDTASA-NSynonyms
C=CCOc1ccc(cc1OC)C1C(=C(C)N=c2n1c(=O)c(=Cc1ccccc1F)s2)C(=O)OC
CC1=C(C(N2C(=O)C(=CC3=CC=CC=C3F)SC2=N1)C4=CC(=C(C=C4)OCC=C)OC)C(=O)OC
InChI=1SC26H23FN2O5Sc15123419111017(1320(19)323)2322(25(31)334)15(2)282629(23)24(30)21(3526)1416867918(16)27h511131423H112H224H3b2114
METHYL(2Z)2((2FLUOROPHENYL)METHYLIDENE)5(3METHOXY4PROP2ENOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2Z)2(2fluorobenzylidene)5(3methoxy4(prop2en1yloxy)phenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD03712793
ZINC000002811735
ZINC000002811737
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