Vitas-M small molecule compound
(3aR,4R,4aR,7aS,8R,8aR)-6-(3-chloro-4-fluorophenyl)-3-[4-(prop-2-en-1-yloxy)phenyl]-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Catalog ID
STK579404
SMILES C=CCOc1ccc(cc1)C1=NO[C@H]2[C@@H]1[C@@H]1C[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(c(c1)Cl)F
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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 C25H20ClFN2O4 MW 466.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20ClFN2O4/c1-2-9-32-14-6-3-12(4-7-14)22-21-15-11-16(23(21)33-28-22)20-19(15)24(30)29(25(20)31)13-5-8-18(27)17(26)10-13/h2-8,10,15-16,19-21,23H,1,9,11H2/t15-,16+,19+,20-,21+,23+/m0/s1InChIKey
QTABPQLVEKSAJS-PUGIJZQRSA-NSynonyms
1013981-87-7(3aR4R4aR7aS8R8aR)3(4(allyloxy)phenyl)6(3chloro4fluorophenyl)44a88atetrahydro3aH48methanoisoxazolo(45f)isoindole57(6H7aH)dione
(3aR4R4aR7aS8R8aR)6(3chloro4fluorophenyl)3(4(prop2en1yloxy)phenyl)4a7a88atetrahydro3aH48methano(12)oxazolo(45f)isoindole57(4H6H)dione
1013981877
C=CCOc1ccc(cc1)C1=NO(C@H)2(C@@H)1(C@@H)1C(C@H)2(C@H)2(C@@H)1C(=O)N(C2=O)c1ccc(c(c1)Cl)F
C=CCOc1ccc(cc1)C1=NO(C@H)2(C@@H)1(C@H)1C(C@@H)2(C@H)2(C@@H)1C(=O)N(C2=O)c1ccc(c(c1)Cl)F
MFCD18245631
ZINC000013815210
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