Vitas-M small molecule compound

ethyl (2E)-2-cyano-3-[2-(4-methylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate

Catalog ID
STK705578
SMILES CCOC(=O)/C(=C/c1c(Oc2ccc(cc2)C)nc2n(c1=O)cccc2)/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 C21H17N3O4 MW 375.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O4/c1-3-27-21(26)15(13-22)12-17-19(28-16-9-7-14(2)8-10-16)23-18-6-4-5-11-24(18)20(17)25/h4-12H,3H2,1-2H3/b15-12+
InChIKey
KKPXVXJUJNPMKM-NTCAYCPXSA-N
Synonyms
620105-37-5
(E)ethyl2cyano3(4oxo2(ptolyloxy)4Hpyrido(12a)pyrimidin3yl)acrylate
620105375
CCOC(=O)C(=CC1=C(N=C2C=CC=CN2C1=O)OC3=CC=C(C=C3)C)C#N
CCOC(=O)C(=Cc1c(Oc2ccc(cc2)C)nc2n(c1=O)cccc2)C#N
ethyl(2E)2cyano3(2(4methylphenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)prop2enoate
ETHYL(E)2CYANO3(2(4METHYLPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENOATE
InChI=1SC21H17N3O4c132721(26)15(1322)121719(28169714(2)81016)23186451124(18)20(17)25h412H3H212H3b1512+
MFCD04188744
ZINC000002423912
ZINC2423912

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Available files

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