Vitas-M small molecule compound
2-benzyl-8-[bis(4-methylphenyl)methylidene]-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Catalog ID
STL384090
SMILES Cc1ccc(cc1)/C(=C/1\C2C=CC1C1C2C(=O)N(C1=O)Cc1ccccc1)/c1ccc(cc1)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 C31H27NO2 MW 445.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27NO2/c1-19-8-12-22(13-9-19)26(23-14-10-20(2)11-15-23)27-24-16-17-25(27)29-28(24)30(33)32(31(29)34)18-21-6-4-3-5-7-21/h3-17,24-25,28-29H,18H2,1-2H3InChIKey
SRFOTTJWRPTJKS-UHFFFAOYSA-NSynonyms
2benzyl8(bis(4methylphenyl)methylidene)3a477atetrahydro1H47methanoisoindole13(2H)dione
CC1=CC=C(C=C1)C(=C2C3C=CC2C4C3C(=O)N(C4=O)CC5=CC=CC=C5)C6=CC=C(C=C6)C
Cc1ccc(cc1)C(=C1C2C=CC1C1C2C(=O)N(C1=O)Cc1ccccc1)c1ccc(cc1)C
InChI=1SC31H27NO2c11981222(13919)26(23141020(2)111523)2724161725(27)2928(24)30(33)32(31(29)34)18216435721h31724252829H18H212H3
MFCD03838706
ZINC000100999578
ZINC000239412417
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