Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-1-(1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)prop-2-en-1-one
Catalog ID
STL465678
SMILES O=C(N1CCc2c(C1)c1ccccc1[nH]2)/C=C/c1ccc2c(c1)OCO2
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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 C21H18N2O3 MW 346.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O3/c24-21(8-6-14-5-7-19-20(11-14)26-13-25-19)23-10-9-18-16(12-23)15-3-1-2-4-17(15)22-18/h1-8,11,22H,9-10,12-13H2/b8-6+InChIKey
SLZZMFJXBGOTPB-SOFGYWHQSA-NSynonyms
1021042-60-3(2E)3(13benzodioxol5yl)1(1345tetrahydro2Hpyrido(43b)indol2yl)prop2en1one
(E)3(13benzodioxol5yl)1(1345tetrahydropyrido(43b)indol2yl)prop2en1one
(E)3(benzo(d)(13)dioxol5yl)1(34dihydro1Hpyrido(43b)indol2(5H)yl)prop2en1one
1021042603
C1CN(CC2=C1NC3=CC=CC=C23)C(=O)C=CC4=CC5=C(C=C4)OCO5
InChI=1SC21H18N2O3c2421(8614571920(1114)26132519)231091816(1223)15312417(15)2218h181122H9101213H2b86+
MFCD12028928
O=C(N1CCc2c(C1)c1ccccc1(nH)2)C=Cc1ccc2c(c1)OCO2
ZINC000009899982
ZINC09899982
ZINC9899982
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