Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-(4-bromophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK045077
SMILES Brc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)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 C24H28BrNO4 MW 474.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28BrNO4/c1-14-20(23(28)30-13-17-5-4-10-29-17)21(15-6-8-16(25)9-7-15)22-18(26-14)11-24(2,3)12-19(22)27/h6-9,17,21,26H,4-5,10-13H2,1-3H3InChIKey
XLRAYDHAZXLXND-UHFFFAOYSA-NSynonyms
Brc1ccc(cc1)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OCC1CCCO1
CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=CC=C(C=C3)Br)C(=O)OCC4CCCO4
InChI=1SC24H28BrNO4c11420(23(28)30131754102917)21(156816(25)9715)2218(2614)1124(23)1219(22)27h69172126H451013H213H3
MFCD02375932
oxolan2ylmethyl4(4bromophenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
STK045077
tetrahydrofuran2ylmethyl4(4bromophenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
ZINC000019770151
ZINC000019770154
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