Vitas-M small molecule compound
(4-{(3aR,4R,4aR,7aS,8R,8aR)-5,7-dioxo-6-[3-(trifluoromethyl)phenyl]-4,4a,5,6,7,7a,8,8a-octahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindol-3-yl}phenoxy)acetonitrile
Catalog ID
STK595058
SMILES N#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)c1cccc(c1)C(F)(F)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 C25H18F3N3O4 MW 481.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18F3N3O4/c26-25(27,28)13-2-1-3-14(10-13)31-23(32)18-16-11-17(19(18)24(31)33)22-20(16)21(30-35-22)12-4-6-15(7-5-12)34-9-8-29/h1-7,10,16-20,22H,9,11H2/t16-,17+,18+,19-,20+,22+/m0/s1InChIKey
VVZOMEOMYHNZLO-DJIXWYQQSA-NSynonyms
1013869-58-3(4((3aR4R4aR7aS8R8aR)57dioxo6(3(trifluoromethyl)phenyl)44a5677a88aoctahydro3aH48methano(12)oxazolo(45f)isoindol3yl)phenoxy)acetonitrile
1013869583
2(4((3aR4R4aR7aS8R8aR)57dioxo6(3(trifluoromethyl)phenyl)44a5677a88aoctahydro3aH48methanoisoxazolo(45f)isoindol3yl)phenoxy)acetonitrile
MFCD18246005
N#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)c1cccc(c1)C(F)(F)F
N#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)c1cccc(c1)C(F)(F)F
ZINC000101270019
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