Vitas-M small molecule compound
ethyl (2Z)-5-(4-fluorophenyl)-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
STL173672
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)F)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 C32H26F4N2O5S MW 626.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H26F4N2O5S/c1-4-42-30(40)27-18(2)37-31-38(28(27)20-9-11-23(33)12-10-20)29(39)26(44-31)15-19-8-13-25(41-3)21(14-19)17-43-24-7-5-6-22(16-24)32(34,35)36/h5-16,28H,4,17H2,1-3H3/b26-15-InChIKey
YWXADAONONWBQL-YSMPRRRNSA-NSynonyms
445036-83-9445036839
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)F)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)F)C(=O)C(=CC4=CC(=C(C=C4)OC)COC5=CC=CC(=C5)C(F)(F)F)S2)C
ETHYL(2Z)5(4FLUOROPHENYL)2((4METHOXY3((3(TRIFLUOROMETHYL)PHENOXY)METHYL)PHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(4fluorophenyl)2(4methoxy3((3(trifluoromethyl)phenoxy)methyl)benzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL5(4FLUOROPHENYL)2(4METHOXY3((3(TRIFLUOROMETHYL)PHENOXY)METHYL)BENZYLIDENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC32H26F4N2O5Sc144230(40)2718(2)373138(28(27)2091123(33)121020)29(39)26(4431)151981325(413)21(1419)17432475622(1624)32(3435)36h51628H417H213H3b2615
MFCD02243547
ZINC000008454493
ZINC000008454494
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