Vitas-M small molecule compound
(2E)-3-[2-(azepan-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyano-N-ethylprop-2-enamide
Catalog ID
STK706777
SMILES CCNC(=O)/C(=C/c1c(nc2n(c1=O)cccc2C)N1CCCCCC1)/C#N
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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 C21H25N5O2 MW 379.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O2/c1-3-23-20(27)16(14-22)13-17-19(25-10-6-4-5-7-11-25)24-18-15(2)9-8-12-26(18)21(17)28/h8-9,12-13H,3-7,10-11H2,1-2H3,(H,23,27)/b16-13+InChIKey
LOPAJRAIPRZUMO-DTQAZKPQSA-NSynonyms
799770-46-0(2E)3(2(azepan1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoNethylprop2enamide
(E)3(2(azepan1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoNethylacrylamide
(E)3(2(AZEPAN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)2CYANONETHYLPROP2ENAMIDE
799770460
CCNC(=O)C(=CC1=C(N=C2C(=CC=CN2C1=O)C)N3CCCCCC3)C#N
CCNC(=O)C(=Cc1c(nc2n(c1=O)cccc2C)N1CCCCCC1)C#N
InChI=1SC21H25N5O2c132320(27)16(1422)131719(251064571125)241815(2)981226(18)21(17)28h891213H371011H212H3(H2327)b1613+
MFCD03671496
ZINC000002203990
ZINC2203990
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