Vitas-M small molecule compound

3-(2,4-dimethoxyphenyl)-6-(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
STL058022
SMILES COc1cc(OC)ccc1C1=NOC2C1C1OC2C2C1C(=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 C24H22N2O6 MW 434.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O6/c1-11-4-6-12(7-5-11)26-23(27)16-17(24(26)28)21-22-18(20(16)31-21)19(25-32-22)14-9-8-13(29-2)10-15(14)30-3/h4-10,16-18,20-22H,1-3H3
InChIKey
MZTJORHDZYNNJI-UHFFFAOYSA-N
Synonyms

(3aS4R4aS7aR8S8aS)3(24dimethoxyphenyl)6(ptolyl)44a88atetrahydro3aH48epoxyisoxazolo(45f)isoindole57(6H7aH)dione
3(24dimethoxyphenyl)6(4methylphenyl)4a7a88atetrahydro3aH48epoxy(12)oxazolo(45f)isoindole57(4H6H)dione
CC1=CC=C(C=C1)N2C(=O)C3C(C2=O)C4C5C(C3O4)C(=NO5)C6=C(C=C(C=C6)OC)OC
COc1cc(OC)ccc1C1=NO(C@H)2(C@@H)1(C@H)1OC2(C@H)2(C@@H)1C(=O)N(C2=O)c1ccc(cc1)C
InChI=1SC24H22N2O6c1114612(7511)2623(27)1617(24(26)28)212218(20(16)3121)19(253222)149813(292)1015(14)303h41016182022H13H3
MFCD18192884
ZINC000016011715
ZINC000245246501

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Available files

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