Vitas-M small molecule compound
2-(1,3-benzodioxol-5-ylmethyl)-3-[2-(4-fluorophenyl)-1H-indol-3-yl]-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one
Catalog ID
STK213067
SMILES Fc1ccc(cc1)c1[nH]c2c(c1C1C3=C(C(=O)N1Cc1ccc4c(c1)OCO4)CCCC3)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 C30H25FN2O3 MW 480.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25FN2O3/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/h3-4,7-15,29,32H,1-2,5-6,16-17H2InChIKey
SLNQJSMJQRYXSU-UHFFFAOYSA-NSynonyms
2(13benzodioxol5ylmethyl)3(2(4fluorophenyl)1Hindol3yl)234567hexahydro1Hisoindol1one
2(13benzodioxol5ylmethyl)3(2(4fluorophenyl)1Hindol3yl)4567tetrahydro3Hisoindol1one
C1CCC2=C(C1)C(N(C2=O)CC3=CC4=C(C=C3)OCO4)C5=C(NC6=CC=CC=C65)C7=CC=C(C=C7)F
Fc1ccc(cc1)c1(nH)c2c(c1C1C3=C(C(=O)N1Cc1ccc4c(c1)OCO4)CCCC3)cccc2
InChI=1SC30H25FN2O3c3120121019(111320)2827(23734824(23)3228)2921512622(21)30(34)33(29)16189142526(1518)36173525h347152932H12561617H2
MFCD08680361
ZINC000010058893
ZINC000010058894
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