Vitas-M small molecule compound
(3aR,4R,4aR,7aS,8R,8aR)-6-(3-chloro-4-fluorophenyl)-3-(4-methoxyphenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-methano[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione
Catalog ID
STK571080
SMILES COc1ccc(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 C23H18ClFN2O4 MW 440.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClFN2O4/c1-30-12-5-2-10(3-6-12)20-19-13-9-14(21(19)31-26-20)18-17(13)22(28)27(23(18)29)11-4-7-16(25)15(24)8-11/h2-8,13-14,17-19,21H,9H2,1H3/t13-,14+,17+,18-,19+,21+/m0/s1InChIKey
PKQWJFJVDRJZMI-MORHTPAJSA-NSynonyms
1013981-62-8(3aR4R4aR7aS8R8aR)6(3chloro4fluorophenyl)3(4methoxyphenyl)44a88atetrahydro3aH48methanoisoxazolo(45f)isoindole57(6H7aH)dione
(3aR4R4aR7aS8R8aR)6(3chloro4fluorophenyl)3(4methoxyphenyl)4a7a88atetrahydro3aH48methano(12)oxazolo(45f)isoindole57(4H6H)dione
1013981628
COc1ccc(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
COc1ccc(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
MFCD18245405
ZINC000009242756
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