Vitas-M small molecule compound

9'-bromo-4,4-dimethyl-2',3',4',4a'-tetrahydro-1'H,2H,6H,6'H-spiro[cyclohexane-1,5'-pyrido[1,2-a]quinoline]-2,6-dione

Catalog ID
STL448442
SMILES Brc1ccc2c(c1)N1CCCCC1C1(C2)C(=O)CC(CC1=O)(C)C

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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 C20H24BrNO2 MW 390.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24BrNO2/c1-19(2)11-17(23)20(18(24)12-19)10-13-6-7-14(21)9-15(13)22-8-4-3-5-16(20)22/h6-7,9,16H,3-5,8,10-12H2,1-2H3
InChIKey
BPBLXNDMYVBBOJ-UHFFFAOYSA-N
Synonyms

9bromo44dimethyl2344atetrahydro1H2H6H6Hspiro(cyclohexane15pyrido(12a)quinoline)26dione
9bromo55dimethylspiro(12344a6hexahydrobenzo(c)quinolizine52cyclohexane)13dione
CC1(CC(=O)C2(CC3=C(C=C(C=C3)Br)N4C2CCCC4)C(=O)C1)C
InChI=1SC20H24BrNO2c119(2)1117(23)20(18(24)1219)10136714(21)915(13)22843516(20)22h67916H3581012H212H3
MFCD07773867
ZINC000004914371
ZINC000004914385

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.