Vitas-M small molecule compound
ethyl (2E)-2-{5-chloro-2-[(4-fluorobenzyl)oxy]benzylidene}-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK055646
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C\c1cc(Cl)ccc1OCc1ccc(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 C32H28ClFN2O6S MW 623.10 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H28ClFN2O6S/c1-5-41-31(38)28-18(2)35-32-36(29(28)20-8-12-25(39-3)26(15-20)40-4)30(37)27(43-32)16-21-14-22(33)9-13-24(21)42-17-19-6-10-23(34)11-7-19/h6-16,29H,5,17H2,1-4H3/b27-16+InChIKey
WYNHALOJVIHARL-JVWAILMASA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1cc(Cl)ccc1OCc1ccc(cc1)F)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC)OC)C(=O)C(=CC4=C(C=CC(=C4)Cl)OCC5=CC=C(C=C5)F)S2)C
ethyl(2E)2((5chloro2((4fluorophenyl)methoxy)phenyl)methylidene)5(34dimethoxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2E)2(5CHLORO2((4FLUOROBENZYL)OXY)BENZYLIDENE)5(34DIMETHOXYPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC32H28ClFN2O6Sc154131(38)2818(2)353236(29(28)2081225(393)26(1520)404)30(37)27(4332)16211422(33)91324(21)42171961023(34)11719h61629H517H214H3b2716+
MFCD08051309
STK055646
ZINC000097958730
ZINC000097958731
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Check stock on Vitas-MAvailable files
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