Vitas-M small molecule compound
3'-(2,3-dimethylphenyl)-4,4-dimethyl-2',3',4',4a'-tetrahydro-1'H,2H,6H,6'H-spiro[cyclohexane-1,5'-pyrazino[1,2-a]quinoline]-2,6-dione
Catalog ID
STL440630
SMILES Cc1cccc(c1C)N1CCN2C(C1)C1(Cc3c2cccc3)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 C27H32N2O2 MW 416.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O2/c1-18-8-7-11-21(19(18)2)28-12-13-29-22-10-6-5-9-20(22)14-27(23(29)17-28)24(30)15-26(3,4)16-25(27)31/h5-11,23H,12-17H2,1-4H3InChIKey
DWQLFVMUFOZMOQ-UHFFFAOYSA-NSynonyms
3(23dimethylphenyl)44dimethyl2344atetrahydro1H2H6H6Hspiro(cyclohexane15pyrazino(12a)quinoline)26dione
3(23dimethylphenyl)55dimethylspiro(244a6tetrahydro1Hpyrazino(12a)quinoline52cyclohexane)13dione
CC1=C(C(=CC=C1)N2CCN3C(C2)C4(CC5=CC=CC=C53)C(=O)CC(CC4=O)(C)C)C
InChI=1SC27H32N2O2c118871121(19(18)2)28121329221065920(22)1427(23(29)1728)24(30)1526(34)1625(27)31h51123H1217H214H3
MFCD09992460
ZINC000033433909
ZINC000248065408
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