Vitas-M small molecule compound
ethyl (2Z)-5-(4-chlorophenyl)-2-{[5-(3-chlorophenyl)furan-2-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL169504
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C/c1ccc(o1)c1cccc(c1)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 C27H20Cl2N2O4S MW 539.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20Cl2N2O4S/c1-3-34-26(33)23-15(2)30-27-31(24(23)16-7-9-18(28)10-8-16)25(32)22(36-27)14-20-11-12-21(35-20)17-5-4-6-19(29)13-17/h4-14,24H,3H2,1-2H3/b22-14-InChIKey
LADUDTTUWFXUAX-HMAPJEAMSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1ccc(o1)c1cccc(c1)Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)Cl)C(=O)C(=CC4=CC=C(O4)C5=CC(=CC=C5)Cl)S2)C
ethyl(2Z)5(4chlorophenyl)2((5(3chlorophenyl)furan2yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4CHLOROPHENYL)2((5(3CHLOROPHENYL)FURAN2YL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC27H20Cl2N2O4Sc133426(33)2315(2)302731(24(23)167918(28)10816)25(32)22(3627)1420111221(3520)1754619(29)1317h41424H3H212H3b2214
MFCD01592386
ZINC000002063321
ZINC000002063323
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