Vitas-M small molecule compound
3-ethyl 6-methyl 4-(4-chloro-3-fluorophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Catalog ID
STK404528
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccc(c(c1)F)Cl)C(=O)C(C(C2)C)C(=O)OC
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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 C22H23ClFNO5 MW 435.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClFNO5/c1-5-30-22(28)17-11(3)25-15-8-10(2)16(21(27)29-4)20(26)19(15)18(17)12-6-7-13(23)14(24)9-12/h6-7,9-10,16,18,25H,5,8H2,1-4H3InChIKey
KJGLYLYLQUUUHQ-UHFFFAOYSA-NSynonyms
3ethyl6methyl4(4chloro3fluorophenyl)27dimethyl5oxo145678hexahydroquinoline36dicarboxylate
3Oethyl6Omethyl4(4chloro3fluorophenyl)27dimethyl5oxo4678tetrahydro1Hquinoline36dicarboxylate
CCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)Cl)F)C(=O)C(C(C2)C)C(=O)OC)C
InChI=1SC22H23ClFNO5c153022(28)1711(3)2515810(2)16(21(27)294)20(26)19(15)18(17)126713(23)14(24)912h67910161825H58H214H3
MFCD04220550
ZINC000020029030
ZINC000035880493
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