Vitas-M small molecule compound
2-({(E)-[4-(benzyloxy)phenyl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-spiro[2-aza-4,7-methanoisoindole-8,1'-cyclopropane]-1,3(2H)-dione
Catalog ID
STL387762
SMILES O=C1C2C(C(=O)N1/N=C/c1ccc(cc1)OCc1ccccc1)C1C3(C2C=C1)CC3
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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 C25H22N2O3 MW 398.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O3/c28-23-21-19-10-11-20(25(19)12-13-25)22(21)24(29)27(23)26-14-16-6-8-18(9-7-16)30-15-17-4-2-1-3-5-17/h1-11,14,19-22H,12-13,15H2/b26-14+InChIKey
BNERDKSSEPDZQJ-VULFUBBASA-NSynonyms
2(((E)(4(benzyloxy)phenyl)methylidene)amino)3a477atetrahydro1Hspiro(2aza47methanoisoindole81cyclopropane)13(2H)dione
C1CC12C3C=CC2C4C3C(=O)N(C4=O)N=CC5=CC=C(C=C5)OCC6=CC=CC=C6
InChI=1SC25H22N2O3c28232119101120(25(19)121325)22(21)24(29)27(23)2614166818(9716)3015174213517h111141922H121315H2b2614+
MFCD01067534
O=C1C2C(C(=O)N1N=Cc1ccc(cc1)OCc1ccccc1)C1C3(C2C=C1)CC3
ZINC000106361193
ZINC000225348694
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