Vitas-M small molecule compound
ethyl (2Z)-7-methyl-3-oxo-5-phenyl-2-({5-[3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK742438
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1ccc(o1)c1cccc(c1)C(F)(F)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 C28H21F3N2O4S MW 538.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21F3N2O4S/c1-3-36-26(35)23-16(2)32-27-33(24(23)17-8-5-4-6-9-17)25(34)22(38-27)15-20-12-13-21(37-20)18-10-7-11-19(14-18)28(29,30)31/h4-15,24H,3H2,1-2H3/b22-15-InChIKey
KXISGKKKSXRMGT-JCMHNJIXSA-NSynonyms
(E)ethyl7methyl3oxo5phenyl2((5(3(trifluoromethyl)phenyl)furan2yl)methylene)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1ccc(o1)c1cccc(c1)C(F)(F)F)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CC=C(O4)C5=CC(=CC=C5)C(F)(F)F)S2)C
ethyl(2Z)7methyl3oxo5phenyl2((5(3(trifluoromethyl)phenyl)furan2yl)methylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)7METHYL3OXO5PHENYL2((5(3(TRIFLUOROMETHYL)PHENYL)FURAN2YL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL7METHYL3OXO5PHENYL2((5(3(TRIFLUOROMETHYL)PHENYL)(2FURYL))METHYLENE)45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H21F3N2O4Sc133626(35)2316(2)322733(24(23)178546917)25(34)22(3827)1520121321(3720)181071119(1418)28(2930)31h41524H3H212H3b2215
MFCD07428971
ZINC000002063038
ZINC000002063040
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