Vitas-M small molecule compound
ethyl (2Z)-2-{[5-(2,4-dichlorophenyl)furan-2-yl]methylidene}-7-methyl-5-(4-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK676191
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)/c(=C/c1ccc(o1)c1ccc(cc1Cl)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 C28H22Cl2N2O4S MW 553.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22Cl2N2O4S/c1-4-35-27(34)24-16(3)31-28-32(25(24)17-7-5-15(2)6-8-17)26(33)23(37-28)14-19-10-12-22(36-19)20-11-9-18(29)13-21(20)30/h5-14,25H,4H2,1-3H3/b23-14-InChIKey
QXTBTNYCXIJOJX-UCQKPKSFSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)c(=Cc1ccc(o1)c1ccc(cc1Cl)Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C)C(=O)C(=CC4=CC=C(O4)C5=C(C=C(C=C5)Cl)Cl)S2)C
ethyl(2Z)2((5(24dichlorophenyl)furan2yl)methylidene)7methyl5(4methylphenyl)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((5(24DICHLOROPHENYL)FURAN2YL)METHYLIDENE)7METHYL5(4METHYLPHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H22Cl2N2O4Sc143527(34)2416(3)312832(25(24)177515(2)6817)26(33)23(3728)1419101222(3619)2011918(29)1321(20)30h51425H4H213H3b2314
MFCD01140736
ZINC000002915547
ZINC000002915550
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