Vitas-M small molecule compound
prop-2-en-1-yl (2Z)-5-(3,4-dimethoxyphenyl)-2-(4-fluorobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK534318
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C/c1ccc(cc1)F)/s2
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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/c1-5-12-34-25(31)22-15(2)28-26-29(23(22)17-8-11-19(32-3)20(14-17)33-4)24(30)21(35-26)13-16-6-9-18(27)10-7-16/h5-11,13-14,23H,1,12H2,2-4H3/b21-13-InChIKey
UQJCYEUCGKPDNE-BKUYFWCQSA-NSynonyms
374550-23-9(Z)allyl5(34dimethoxyphenyl)2(4fluorobenzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
374550239
C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1ccc(cc1)F)s2
CC1=C(C(N2C(=O)C(=CC3=CC=C(C=C3)F)SC2=N1)C4=CC(=C(C=C4)OC)OC)C(=O)OCC=C
InChI=1SC26H23FN2O5Sc15123425(31)2215(2)282629(23(22)1781119(323)20(1417)334)24(30)21(3526)13166918(27)10716h511131423H112H224H3b2113
MFCD01957373
prop2en1yl(2Z)5(34dimethoxyphenyl)2(4fluorobenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROP2ENYL(2Z)5(34DIMETHOXYPHENYL)2((4FLUOROPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000009339724
ZINC000009339725
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