Vitas-M small molecule compound
3-benzyl-9-chloro-5'-methyl-2'-(4-methylphenyl)-2,3,4,4a-tetrahydro-1H,6H-spiro[pyrazino[1,2-a]quinoline-5,4'-pyrazol]-3'(2'H)-one
Catalog ID
STL437357
SMILES Clc1ccc2c(c1)N1CCN(CC1C1(C2)C(=NN(C1=O)c1ccc(cc1)C)C)Cc1ccccc1
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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 C29H29ClN4O MW 485.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29ClN4O/c1-20-8-12-25(13-9-20)34-28(35)29(21(2)31-34)17-23-10-11-24(30)16-26(23)33-15-14-32(19-27(29)33)18-22-6-4-3-5-7-22/h3-13,16,27H,14-15,17-19H2,1-2H3InChIKey
MIEOGAKZEZQIJG-UHFFFAOYSA-NSynonyms
3benzyl9chloro5methyl2(4methylphenyl)2344atetrahydro1H6Hspiro(pyrazino(12a)quinoline54pyrazol)3(2H)one
3benzyl9chloro5methyl2(4methylphenyl)spiro(244a6tetrahydro1Hpyrazino(12a)quinoline54pyrazole)3one
CC1=CC=C(C=C1)N2C(=O)C3(CC4=C(C=C(C=C4)Cl)N5C3CN(CC5)CC6=CC=CC=C6)C(=N2)C
InChI=1SC29H29ClN4Oc12081225(13920)3428(35)29(21(2)3134)1723101124(30)1626(23)33151432(1927(29)33)18226435722h3131627H14151719H212H3
MFCD09992100
ZINC000033428981
ZINC000230156983
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