Vitas-M small molecule compound
(2E)-2-(3,4-dihydroisoquinolin-2(1H)-ylcarbonyl)-3-(1H-pyrrol-2-yl)prop-2-enenitrile
Catalog ID
STL168252
SMILES N#C/C(=C\c1[nH]ccc1)/C(=O)N1CCc2c(C1)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 C17H15N3O MW 277.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O/c18-11-15(10-16-6-3-8-19-16)17(21)20-9-7-13-4-1-2-5-14(13)12-20/h1-6,8,10,19H,7,9,12H2/b15-10+InChIKey
XSTNGCOZFPROBK-XNTDXEJSSA-NSynonyms
(2E)2(34dihydroisoquinolin2(1H)ylcarbonyl)3(1Hpyrrol2yl)prop2enenitrile
(E)2(34DIHYDRO1HISOQUINOLINE2CARBONYL)3(1HPYRROL2YL)PROP2ENENITRILE
2(34DIHYDRO1HISOQUINOLINE2CARBONYL)3(1HPYRROL2YL)ACRYLONITRILE
C1CN(CC2=CC=CC=C21)C(=O)C(=CC3=CC=CN3)C#N
InChI=1SC17H15N3Oc181115(10166381916)17(21)209713412514(13)1220h1681019H7912H2b1510+
MFCD02197495
N#CC(=Cc1(nH)ccc1)C(=O)N1CCc2c(C1)cccc2
ZINC000000331495
ZINC00331495
ZINC331495
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