Vitas-M small molecule compound
8-bromo-3-(3-chlorophenyl)-2'-(4-chlorophenyl)-5'-methyl-2,3,4,4a-tetrahydro-1H,6H-spiro[pyrazino[1,2-a]quinoline-5,4'-pyrazol]-3'(2'H)-one
Catalog ID
STL437391
SMILES Brc1ccc2c(c1)CC1(C3N2CCN(C3)c2cccc(c2)Cl)C(=NN(C1=O)c1ccc(cc1)Cl)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 C27H23BrCl2N4O MW 570.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23BrCl2N4O/c1-17-27(26(35)34(31-17)22-8-6-20(29)7-9-22)15-18-13-19(28)5-10-24(18)33-12-11-32(16-25(27)33)23-4-2-3-21(30)14-23/h2-10,13-14,25H,11-12,15-16H2,1H3InChIKey
GOHXXEQHUADLEC-UHFFFAOYSA-NSynonyms
8bromo3(3chlorophenyl)2(4chlorophenyl)5methyl2344atetrahydro1H6Hspiro(pyrazino(12a)quinoline54pyrazol)3(2H)one
8bromo3(3chlorophenyl)2(4chlorophenyl)5methylspiro(244a6tetrahydro1Hpyrazino(12a)quinoline54pyrazole)3one
CC1=NN(C(=O)C12CC3=C(C=CC(=C3)Br)N4C2CN(CC4)C5=CC(=CC=C5)Cl)C6=CC=C(C=C6)Cl
InChI=1SC27H23BrCl2N4Oc11727(26(35)34(3117)228620(29)7922)15181319(28)51024(18)33121132(1625(27)33)2342321(30)1423h210131425H11121516H21H3
MFCD09992133
ZINC000101391732
ZINC000103405480
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