Vitas-M small molecule compound
methyl (2E)-3-[2-(benzylamino)-4-chloro-6-methylpyrimidin-5-yl]prop-2-enoate
Catalog ID
STK700788
SMILES COC(=O)/C=C/c1c(C)nc(nc1Cl)NCc1ccccc1
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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 C16H16ClN3O2 MW 317.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16ClN3O2/c1-11-13(8-9-14(21)22-2)15(17)20-16(19-11)18-10-12-6-4-3-5-7-12/h3-9H,10H2,1-2H3,(H,18,19,20)/b9-8+InChIKey
QGDBZUYRPCIHRJ-CMDGGOBGSA-NSynonyms
(E)methyl3(2(benzylamino)4chloro6methylpyrimidin5yl)acrylate
CC1=C(C(=NC(=N1)NCC2=CC=CC=C2)Cl)C=CC(=O)OC
COC(=O)C=Cc1c(C)nc(nc1Cl)NCc1ccccc1
InChI=1SC16H16ClN3O2c11113(8914(21)222)15(17)2016(1911)1810126435712h39H10H212H3(H181920)b98+
methyl(2E)3(2(benzylamino)4chloro6methylpyrimidin5yl)prop2enoate
METHYL(E)3(2(BENZYLAMINO)4CHLORO6METHYLPYRIMIDIN5YL)PROP2ENOATE
MFCD01464588
ZINC000004833940
ZINC04833940
ZINC4833940
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