Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-(3,4-dichlorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK058078
SMILES O=C(C1=C(C)NC2=C(C1c1ccc(c(c1)Cl)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/c1-12-19(22(27)29-11-14-4-3-9-28-14)20(13-7-8-15(23)16(24)10-13)21-17(25-12)5-2-6-18(21)26/h7-8,10,14,20,25H,2-6,9,11H2,1H3InChIKey
VXZUKRAFFSJKCM-UHFFFAOYSA-NSynonyms
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC(=C(C=C3)Cl)Cl)C(=O)OCC4CCCO4
InChI=1SC22H23Cl2NO4c11219(22(27)2911144392814)20(137815(23)16(24)1013)2117(2512)52618(21)26h7810142025H26911H21H3
MFCD02375931
O=C(C1=C(C)NC2=C(C1c1ccc(c(c1)Cl)Cl)C(=O)CCC2)OCC1CCCO1
oxolan2ylmethyl4(34dichlorophenyl)2methyl5oxo4678tetrahydro1Hquinoline3carboxylate
STK058078
tetrahydrofuran2ylmethyl4(34dichlorophenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
ZINC000001201909
ZINC000001201919
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