Vitas-M small molecule compound
3-(4-methoxyphenyl)-5'-methyl-2'-phenyl-2,3,4,4a-tetrahydro-1H,6H-spiro[pyrazino[1,2-a]quinoline-5,4'-pyrazol]-3'(2'H)-one
Catalog ID
STL437318
SMILES COc1ccc(cc1)N1CCN2C(C1)C1(Cc3c2cccc3)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 C28H28N4O2 MW 452.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O2/c1-20-28(27(33)32(29-20)23-9-4-3-5-10-23)18-21-8-6-7-11-25(21)31-17-16-30(19-26(28)31)22-12-14-24(34-2)15-13-22/h3-15,26H,16-19H2,1-2H3InChIKey
ZAOVBBKSHQSSEA-UHFFFAOYSA-NSynonyms
3(4methoxyphenyl)5methyl2phenyl2344atetrahydro1H6Hspiro(pyrazino(12a)quinoline54pyrazol)3(2H)one
3(4methoxyphenyl)5methyl2phenylspiro(244a6tetrahydro1Hpyrazino(12a)quinoline54pyrazole)3one
CC1=NN(C(=O)C12CC3=CC=CC=C3N4C2CN(CC4)C5=CC=C(C=C5)OC)C6=CC=CC=C6
InChI=1SC28H28N4O2c12028(27(33)32(2920)2394351023)18218671125(21)31171630(1926(28)31)22121424(342)151322h31526H1619H212H3
MFCD09992061
ZINC000025184327
ZINC000248155804
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