Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-N-(4,6-dimethylpyrimidin-2-yl)prop-2-enamide
Catalog ID
STK018276
SMILES O=C(Nc1nc(C)cc(n1)C)/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 C16H15N3O3 MW 297.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O3/c1-10-7-11(2)18-16(17-10)19-15(20)6-4-12-3-5-13-14(8-12)22-9-21-13/h3-8H,9H2,1-2H3,(H,17,18,19,20)/b6-4+InChIKey
XXQJYMLRKOIPIP-GQCTYLIASA-NSynonyms
349541-50-0(2E)3(13BENZODIOXOL5YL)N(46DIMETHYLPYRIMIDIN2YL)PROP2ENAMIDE
(E)3(13BENZODIOXOL5YL)N(46DIMETHYLPYRIMIDIN2YL)PROP2ENAMIDE
(E)3(benzo(d)(13)dioxol5yl)N(46dimethylpyrimidin2yl)acrylamide
349541500
CC1=CC(=NC(=N1)NC(=O)C=CC2=CC3=C(C=C2)OCO3)C
InChI=1SC16H15N3O3c110711(2)1816(1710)1915(20)6412351314(812)2292113h38H9H212H3(H17181920)b64+
MFCD02862668
O=C(Nc1nc(C)cc(n1)C)C=Cc1ccc2c(c1)OCO2
STK018276
ZINC000000457038
ZINC00457038
ZINC457038
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