Vitas-M small molecule compound
ethyl (2Z)-2-(3-bromobenzylidene)-5-[4-(methoxycarbonyl)phenyl]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK880471
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(=O)OC)c(=O)/c(=C/c1cccc(c1)Br)/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 C25H21BrN2O5S MW 541.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21BrN2O5S/c1-4-33-24(31)20-14(2)27-25-28(21(20)16-8-10-17(11-9-16)23(30)32-3)22(29)19(34-25)13-15-6-5-7-18(26)12-15/h5-13,21H,4H2,1-3H3/b19-13-InChIKey
YNMTXMWABYWKDJ-UYRXBGFRSA-NSynonyms
609795-98-4609795984
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(=O)OC)c(=O)c(=Cc1cccc(c1)Br)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(=O)OC)C(=O)C(=CC4=CC(=CC=C4)Br)S2)C
ETHYL(2Z)2((3BROMOPHENYL)METHYLIDENE)5(4METHOXYCARBONYLPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(3bromobenzylidene)5(4(methoxycarbonyl)phenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL2(3BROMOBENZYLIDENE)5(4(METHOXYCARBONYL)PHENYL)7METHYL3OXO35DIHYDRO2HTHIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC25H21BrN2O5Sc143324(31)2014(2)272528(21(20)1681017(11916)23(30)323)22(29)19(3425)131565718(26)1215h51321H4H213H3b1913
MFCD03518031
ZINC000002508830
ZINC000002681396
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