Vitas-M small molecule compound

(3aS,4R,4aS,7aR,8R,8aS)-3,6-bis(4-methylphenyl)-4a,7a,8,8a-tetrahydro-3aH-4,8-epoxy[1,2]oxazolo[4,5-f]isoindole-5,7(4H,6H)-dione

Catalog ID
STK574971
SMILES Cc1ccc(cc1)C1=NO[C@H]2[C@@H]1[C@@H]1O[C@H]2[C@H]2[C@@H]1C(=O)N(C2=O)c1ccc(cc1)C

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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 C23H20N2O4 MW 388.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N2O4/c1-11-3-7-13(8-4-11)18-17-19-15-16(20(28-19)21(17)29-24-18)23(27)25(22(15)26)14-9-5-12(2)6-10-14/h3-10,15-17,19-21H,1-2H3/t15-,16+,17-,19-,20+,21-/m0/s1
InChIKey
JULWPSFCYHVUQG-LLGWXDCBSA-N
Synonyms
1212301-30-8
(3aS4R4aS7aR8R8aS)36bis(4methylphenyl)4a7a88atetrahydro3aH48epoxy(12)oxazolo(45f)isoindole57(4H6H)dione
(3aS4R4aS7aR8R8aS)36diptolyl44a88atetrahydro3aH48epoxyisoxazolo(45f)isoindole57(6H7aH)dione
1212301308
CC1=CC=C(C=C1)C2=NOC3C2C4C5C(C3O4)C(=O)N(C5=O)C6=CC=C(C=C6)C
Cc1ccc(cc1)C1=NO(C@H)2(C@@H)1(C@@H)1O(C@H)2(C@H)2(C@@H)1C(=O)N(C2=O)c1ccc(cc1)C
Cc1ccc(cc1)C1=NO(C@H)2(C@@H)1(C@H)1O(C@@H)2(C@H)2(C@@H)1C(=O)N(C2=O)c1ccc(cc1)C
InChI=1SC23H20N2O4c1113713(8411)1817191516(20(2819)21(17)292418)23(27)25(22(15)26)149512(2)61014h31015171921H12H3t1516+1719+2021m0s1
MFCD18245520
ZINC000005389764

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Available files

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