Vitas-M small molecule compound
ethyl (2Z)-5-(4-chlorophenyl)-2-[4-(methoxycarbonyl)benzylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK804712
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C/c1ccc(cc1)C(=O)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 C25H21ClN2O5S MW 496.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O5S/c1-4-33-24(31)20-14(2)27-25-28(21(20)16-9-11-18(26)12-10-16)22(29)19(34-25)13-15-5-7-17(8-6-15)23(30)32-3/h5-13,21H,4H2,1-3H3/b19-13-InChIKey
GIVZAVYCQVLKCH-UYRXBGFRSA-NSynonyms
(E)ethyl5(4chlorophenyl)2(4(methoxycarbonyl)benzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1ccc(cc1)C(=O)OC)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)Cl)C(=O)C(=CC4=CC=C(C=C4)C(=O)OC)S2)C
ETHYL(2Z)5(4CHLOROPHENYL)2((4METHOXYCARBONYLPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(4chlorophenyl)2(4(methoxycarbonyl)benzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC25H21ClN2O5Sc143324(31)2014(2)272528(21(20)1691118(26)121016)22(29)19(3425)13155717(8615)23(30)323h51321H4H213H3b1913
MFCD02109395
ZINC000002288273
ZINC000002288275
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