Vitas-M small molecule compound
8-bromo-3,5'-dimethyl-2'-phenyl-2,3,4,4a-tetrahydro-1H,6H-spiro[pyrazino[1,2-a]quinoline-5,4'-pyrazol]-3'(2'H)-one
Catalog ID
STL437334
SMILES CN1CCN2C(C1)C1(Cc3c2ccc(c3)Br)C(=NN(C1=O)c1ccccc1)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 C22H23BrN4O MW 439.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23BrN4O/c1-15-22(21(28)27(24-15)18-6-4-3-5-7-18)13-16-12-17(23)8-9-19(16)26-11-10-25(2)14-20(22)26/h3-9,12,20H,10-11,13-14H2,1-2H3InChIKey
BFOGSGSBDUJOMY-UHFFFAOYSA-NSynonyms
8bromo35dimethyl2phenyl2344atetrahydro1H6Hspiro(pyrazino(12a)quinoline54pyrazol)3(2H)one
8bromo35dimethyl2phenylspiro(244a6tetrahydro1Hpyrazino(12a)quinoline54pyrazole)3one
CC1=NN(C(=O)C12CC3=C(C=CC(=C3)Br)N4C2CN(CC4)C)C5=CC=CC=C5
InChI=1SC22H23BrN4Oc11522(21(28)27(2415)186435718)13161217(23)8919(16)26111025(2)1420(22)26h391220H10111314H212H3
MFCD09992077
ZINC000025184535
ZINC000248085622
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