Vitas-M small molecule compound
8-[(3-bromo-4-methoxyphenyl)carbonyl]-10-(naphthalen-2-yl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STL049576
SMILES COc1ccc(cc1Br)C(=O)C1N2C=Cc3c(C2C2C1C(=O)N(C2=O)c1ccc2c(c1)cccc2)cccc3
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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 C32H23BrN2O4 MW 579.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H23BrN2O4/c1-39-25-13-11-21(17-24(25)33)30(36)29-27-26(28-23-9-5-4-7-19(23)14-15-34(28)29)31(37)35(32(27)38)22-12-10-18-6-2-3-8-20(18)16-22/h2-17,26-29H,1H3InChIKey
GWGGOWNREBFCLX-UHFFFAOYSA-NSynonyms
(8R8aS11aR11bR)8(3bromo4methoxybenzoyl)10(naphthalen2yl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
8((3bromo4methoxyphenyl)carbonyl)10(naphthalen2yl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
COC1=C(C=C(C=C1)C(=O)C2C3C(C4N2C=CC5=CC=CC=C45)C(=O)N(C3=O)C6=CC7=CC=CC=C7C=C6)Br
COc1ccc(cc1Br)C(=O)(C@@H)1N2C=Cc3c((C@H)2(C@H)2(C@@H)1C(=O)N(C2=O)c1ccc2c(c1)cccc2)cccc3
InChI=1SC32H23BrN2O4c13925131121(1724(25)33)30(36)292726(2823954719(23)141534(28)29)31(37)35(32(27)38)22121018623820(18)1622h2172629H1H3
MFCD05734909
ZINC000102885962
ZINC000245246060
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