Vitas-M small molecule compound
(8S,8aR,11aS)-10-(4-bromophenyl)-8-[(4-methoxyphenyl)carbonyl]-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Catalog ID
STK545985
SMILES COc1ccc(cc1)C(=O)[C@H]1N2C=Cc3c(C2[C@@H]2[C@H]1C(=O)N(C2=O)c1ccc(cc1)Br)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 C28H21BrN2O4 MW 529.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21BrN2O4/c1-35-20-12-6-17(7-13-20)26(32)25-23-22(24-21-5-3-2-4-16(21)14-15-30(24)25)27(33)31(28(23)34)19-10-8-18(29)9-11-19/h2-15,22-25H,1H3/t22-,23+,24?,25-/m0/s1InChIKey
AQJVLBHXEAPHRD-NPZNXQLHSA-NSynonyms
956926-26-4(8S8aR11aS)10(4bromophenyl)8((4methoxyphenyl)carbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
(8S8aR11aS)10(4bromophenyl)8(4methoxybenzoyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)isoquinoline911(8aH10H)dione
956926264
COC1=CC=C(C=C1)C(=O)C2C3C(C4N2C=CC5=CC=CC=C45)C(=O)N(C3=O)C6=CC=C(C=C6)Br
COc1ccc(cc1)C(=O)(C@H)1N2C=Cc3c(C2(C@@H)2(C@H)1C(=O)N(C2=O)c1ccc(cc1)Br)cccc3
InChI=1SC28H21BrN2O4c1352012617(71320)26(32)252322(2421532416(21)141530(24)25)27(33)31(28(23)34)1910818(29)91119h2152225H1H3t2223+24?25m0s1
MFCD18242262
ZINC000100835292
ZINC000100835293
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.