Vitas-M small molecule compound
ethyl (2Z)-5-(4-methoxyphenyl)-2-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}benzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL173670
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C/c1ccc(c(c1)COc1cccc(c1)C(F)(F)F)OC)/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 C33H29F3N2O6S MW 638.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29F3N2O6S/c1-5-43-31(40)28-19(2)37-32-38(29(28)21-10-12-24(41-3)13-11-21)30(39)27(45-32)16-20-9-14-26(42-4)22(15-20)18-44-25-8-6-7-23(17-25)33(34,35)36/h6-17,29H,5,18H2,1-4H3/b27-16-InChIKey
CEPQJQPQOKSTMC-YUMHPJSZSA-NSynonyms
445036-20-4445036204
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1ccc(c(c1)COc1cccc(c1)C(F)(F)F)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC)C(=O)C(=CC4=CC(=C(C=C4)OC)COC5=CC=CC(=C5)C(F)(F)F)S2)C
ETHYL(2Z)5(4METHOXYPHENYL)2((4METHOXY3((3(TRIFLUOROMETHYL)PHENOXY)METHYL)PHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(4methoxyphenyl)2(4methoxy3((3(trifluoromethyl)phenoxy)methyl)benzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL5(4METHOXYPHENYL)2(4METHOXY3((3(TRIFLUOROMETHYL)PHENOXY)METHYL)BENZYLIDENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC33H29F3N2O6Sc154331(40)2819(2)373238(29(28)21101224(413)131121)30(39)27(4532)162091426(424)22(1520)18442586723(1725)33(3435)36h61729H518H214H3b2716
MFCD02243306
ZINC000008454489
ZINC000008454490
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