Vitas-M small molecule compound
ethyl 6,7,8-trifluoro-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-4-oxo-1,4-dihydroquinoline-3-carboxylate
Catalog ID
STK777046
SMILES CCOC(=O)c1cn(c2scc(n2)c2cccc(c2)[N+](=O)[O-])c2c(c1=O)cc(c(c2F)F)F
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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 C21H12F3N3O5S MW 475.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12F3N3O5S/c1-2-32-20(29)13-8-26(18-12(19(13)28)7-14(22)16(23)17(18)24)21-25-15(9-33-21)10-4-3-5-11(6-10)27(30)31/h3-9H,2H2,1H3InChIKey
OYXWTDZZYCORGK-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)F)F)F)C3=NC(=CS3)C4=CC(=CC=C4)(N+)(=O)(O)
CCOC(=O)c1cn(c2scc(n2)c2cccc(c2)(N+)(=O)(O))c2c(c1=O)cc(c(c2F)F)F
ethyl678trifluoro1(4(3nitrophenyl)13thiazol2yl)4oxo14dihydroquinoline3carboxylate
ETHYL678TRIFLUORO1(4(3NITROPHENYL)13THIAZOL2YL)4OXOQUINOLINE3CARBOXYLATE
InChI=1SC21H12F3N3O5Sc123220(29)13826(1812(19(13)28)714(22)16(23)17(18)24)212515(93321)1043511(610)27(30)31h39H2H21H3
MFCD05259941
ZINC000001424430
ZINC01424430
ZINC1424430
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