Vitas-M small molecule compound
tetrahydrofuran-2-ylmethyl 4-(3-bromophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK049016
SMILES Brc1cccc(c1)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)30-13-17-8-5-9-29-17)21(15-6-4-7-16(25)10-15)22-18(26-14)11-24(2,3)12-19(22)27/h4,6-7,10,17,21,26H,5,8-9,11-13H2,1-3H3InChIKey
UUEVMBRVIUIASZ-UHFFFAOYSA-NSynonyms
Brc1cccc(c1)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(=CC=C3)Br)C(=O)OCC4CCCO4
InChI=1SC24H28BrNO4c11420(23(28)3013178592917)21(1564716(25)1015)2218(2614)1124(23)1219(22)27h46710172126H5891113H213H3
MFCD01445727
oxolan2ylmethyl4(3bromophenyl)277trimethyl5oxo1468tetrahydroquinoline3carboxylate
STK049016
tetrahydrofuran2ylmethyl4(3bromophenyl)277trimethyl5oxo145678hexahydroquinoline3carboxylate
ZINC000000847996
ZINC000000847999
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