Vitas-M small molecule compound
2,8-bis(3-chloro-4-methylphenyl)-5-phenyl-3a,4,6,6a,9a,10,10a,10b-octahydro-6,10-ethenoisoindolo[5,6-e]isoindole-1,3,7,9(2H,8H)-tetrone
Catalog ID
STK673037
SMILES O=C1N(c2ccc(c(c2)Cl)C)C(=O)C2C1CC(=C1C2C2C=CC1C1C2C(=O)N(C1=O)c1ccc(c(c1)Cl)C)c1ccccc1
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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 C36H28Cl2N2O4 MW 623.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H28Cl2N2O4/c1-17-8-10-20(14-26(17)37)39-33(41)25-16-24(19-6-4-3-5-7-19)28-22-12-13-23(29(28)32(25)36(39)44)31-30(22)34(42)40(35(31)43)21-11-9-18(2)27(38)15-21/h3-15,22-23,25,29-32H,16H2,1-2H3InChIKey
HBPYFEDUIBVUNN-UHFFFAOYSA-NSynonyms
28bis(3chloro4methylphenyl)5phenyl3a466a9a1010a10boctahydro610ethenoisoindolo(56e)isoindole1379(2H8H)tetrone
CC1=C(C=C(C=C1)N2C(=O)C3CC(=C4C5C=CC(C4C3C2=O)C6C5C(=O)N(C6=O)C7=CC(=C(C=C7)C)Cl)C8=CC=CC=C8)Cl
InChI=1SC36H28Cl2N2O4c11781020(1426(17)37)3933(41)251624(196435719)2822121323(29(28)32(25)36(39)44)3130(22)34(42)40(35(31)43)2111918(2)27(38)1521h3152223252932H16H212H3
MFCD00827646
ZINC000169683768
ZINC000239308958
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