Vitas-M small molecule compound
9-{4-[(2-chloro-4-fluorobenzyl)oxy]-3-methoxyphenyl}-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Catalog ID
STL426976
SMILES COc1cc(ccc1OCc1ccc(cc1Cl)F)C1C2=C(CCCC2=O)NC2=C1C(=O)CCC2
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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 C27H25ClFNO4 MW 481.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25ClFNO4/c1-33-24-12-15(9-11-23(24)34-14-16-8-10-17(29)13-18(16)28)25-26-19(4-2-6-21(26)31)30-20-5-3-7-22(32)27(20)25/h8-13,25,30H,2-7,14H2,1H3InChIKey
CFBDSNFAAPGBRF-UHFFFAOYSA-NSynonyms
9(4((2chloro4fluorobenzyl)oxy)3methoxyphenyl)3467910hexahydroacridine18(2H5H)dione
9(4((2chloro4fluorophenyl)methoxy)3methoxyphenyl)234567910octahydroacridine18dione
COC1=C(C=CC(=C1)C2C3=C(CCCC3=O)NC4=C2C(=O)CCC4)OCC5=C(C=C(C=C5)F)Cl
InChI=1SC27H25ClFNO4c133241215(91123(24)34141681017(29)1318(16)28)252619(42621(26)31)302053722(32)27(20)25h8132530H2714H21H3
MFCD04512012
ZINC000001077790
ZINC01077790
ZINC1077790
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