Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-(2,3-dichlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK095975
SMILES O=C(C1=C(C)NC2=C(C1c1cccc(c1Cl)Cl)C(=O)CCC2)OCC1CCCO1
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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 C22H23Cl2NO4 MW 436.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23Cl2NO4/c1-12-18(22(27)29-11-13-5-4-10-28-13)19(14-6-2-7-15(23)21(14)24)20-16(25-12)8-3-9-17(20)26/h2,6-7,13,19,25H,3-5,8-11H2,1H3InChIKey
MUPICDCWFBMSGF-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CCCC2=O)C3=C(C(=CC=C3)Cl)Cl)C(=O)OCC4CCCO4
InChI=1SC22H23Cl2NO4c11218(22(27)29111354102813)19(1462715(23)21(14)24)2016(2512)83917(20)26h267131925H35811H21H3
MFCD02375919
O=C(C1=C(C)NC2=C(C1c1cccc(c1Cl)Cl)C(=O)CCC2)OCC1CCCO1
oxolan2ylmethyl4(23dichlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
STK095975
tetrahydrofuran2ylmethyl4(23dichlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
ZINC000001201704
ZINC000001201714
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