Vitas-M small molecule compound
ethyl (2E)-5-(4-chlorophenyl)-2-{[5-(3,4-dichlorophenyl)furan-2-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK071901
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C\c1ccc(o1)c1ccc(c(c1)Cl)Cl)/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 C27H19Cl3N2O4S MW 573.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19Cl3N2O4S/c1-3-35-26(34)23-14(2)31-27-32(24(23)15-4-7-17(28)8-5-15)25(33)22(37-27)13-18-9-11-21(36-18)16-6-10-19(29)20(30)12-16/h4-13,24H,3H2,1-2H3/b22-13+InChIKey
FGXYGIHXBVGQJB-LPYMAVHISA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1ccc(o1)c1ccc(c(c1)Cl)Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)Cl)C(=O)C(=CC4=CC=C(O4)C5=CC(=C(C=C5)Cl)Cl)S2)C
ETHYL(2E)5(4CHLOROPHENYL)2((5(34DICHLOROPHENYL)FURAN2YL)METHYLIDENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2E)5(4CHLOROPHENYL)2((5(34DICHLOROPHENYL)FURAN2YL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC27H19Cl3N2O4Sc133526(34)2314(2)312732(24(23)154717(28)8515)25(33)22(3727)131891121(3618)1661019(29)20(30)1216h41324H3H212H3b2213+
MFCD01155571
STK071901
ZINC000006489054
ZINC000006489065
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.