Vitas-M small molecule compound
ethyl (2Z)-5-(4-chlorophenyl)-2-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK522594
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C/c1ccc(c(c1)OC)OCc1ccc(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 C31H26ClFN2O5S MW 593.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H26ClFN2O5S/c1-4-39-30(37)27-18(2)34-31-35(28(27)21-8-10-22(32)11-9-21)29(36)26(41-31)16-20-7-14-24(25(15-20)38-3)40-17-19-5-12-23(33)13-6-19/h5-16,28H,4,17H2,1-3H3/b26-16-InChIKey
MSNBNBKRFFWGSY-QQXSKIMKSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1ccc(c(c1)OC)OCc1ccc(cc1)F)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)Cl)C(=O)C(=CC4=CC(=C(C=C4)OCC5=CC=C(C=C5)F)OC)S2)C
ETHYL(2Z)5(4CHLOROPHENYL)2((4((4FLUOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(4chlorophenyl)2(4((4fluorobenzyl)oxy)3methoxybenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC31H26ClFN2O5Sc143930(37)2718(2)343135(28(27)2181022(32)11921)29(36)26(4131)162071424(25(1520)383)40171951223(33)13619h51628H417H213H3b2616
MFCD02109397
ZINC000100617759
ZINC000100617761
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.