Vitas-M small molecule compound
2-(1,3-benzodioxol-5-ylmethyl)-3-[2-(4-bromophenyl)-1H-indol-3-yl]-2,3-dihydro-1H-isoindol-1-one
Catalog ID
STK175516
SMILES Brc1ccc(cc1)c1[nH]c2c(c1C1N(Cc3ccc4c(c3)OCO4)C(=O)c3c1cccc3)cccc2
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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 C30H21BrN2O3 MW 537.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H21BrN2O3/c31-20-12-10-19(11-13-20)28-27(23-7-3-4-8-24(23)32-28)29-21-5-1-2-6-22(21)30(34)33(29)16-18-9-14-25-26(15-18)36-17-35-25/h1-15,29,32H,16-17H2InChIKey
FMQSUYCMPJEADJ-UHFFFAOYSA-NSynonyms
2(13BENZODIOXOL5YLMETHYL)3(2(4BROMOPHENYL)1HINDOL3YL)23DIHYDRO1HISOINDOL1ONE
2(13benzodioxol5ylmethyl)3(2(4bromophenyl)1Hindol3yl)3Hisoindol1one
Brc1ccc(cc1)c1(nH)c2c(c1C1N(Cc3ccc4c(c3)OCO4)C(=O)c3c1cccc3)cccc2
C1OC2=C(O1)C=C(C=C2)CN3C(C4=CC=CC=C4C3=O)C5=C(NC6=CC=CC=C65)C7=CC=C(C=C7)Br
InChI=1SC30H21BrN2O3c3120121019(111320)2827(23734824(23)3228)2921512622(21)30(34)33(29)16189142526(1518)36173525h1152932H1617H2
MFCD08680268
ZINC000098045573
ZINC000098045574
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