Vitas-M small molecule compound
(3aR,4R,4aR,7aS,8R,8aR)-3-(2-chlorophenyl)-6-[3-(trifluoromethyl)phenyl]-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Catalog ID
STK590231
SMILES O=C1N(c2cccc(c2)C(F)(F)F)C(=O)[C@@H]2[C@H]1[C@H]1C[C@@H]2[C@@H]2[C@H]1C(=NO2)c1ccccc1Cl
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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 C23H16ClF3N2O3 MW 460.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16ClF3N2O3/c24-15-7-2-1-6-12(15)19-18-13-9-14(20(18)32-28-19)17-16(13)21(30)29(22(17)31)11-5-3-4-10(8-11)23(25,26)27/h1-8,13-14,16-18,20H,9H2/t13-,14+,16+,17-,18+,20+/m0/s1InChIKey
YVJRMHIEOZIJKH-QCTDFANMSA-NSynonyms
1014003-29-2(3aR4R4aR7aS8R8aR)3(2chlorophenyl)6(3(trifluoromethyl)phenyl)44a88atetrahydro3aH48methanoisoxazolo(45f)isoindole57(6H7aH)dione
(3aR4R4aR7aS8R8aR)3(2chlorophenyl)6(3(trifluoromethyl)phenyl)4a7a88atetrahydro3aH48methano(12)oxazolo(45f)isoindole57(4H6H)dione
1014003292
MFCD18245877
O=C1N(c2cccc(c2)C(F)(F)F)C(=O)(C@@H)2(C@H)1(C@@H)1C(C@H)2(C@@H)2(C@H)1C(=NO2)c1ccccc1Cl
O=C1N(c2cccc(c2)C(F)(F)F)C(=O)(C@@H)2(C@H)1(C@H)1C(C@@H)2(C@@H)2(C@H)1C(=NO2)c1ccccc1Cl
ZINC000009236027
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