Vitas-M small molecule compound
methyl (2E)-2-cyano-3-[2-(2,4-dimethylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate
Catalog ID
STK904487
SMILES N#C/C(=C\c1c(Oc2ccc(cc2C)C)nc2n(c1=O)cccc2)/C(=O)OC
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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/c1-13-7-8-17(14(2)10-13)28-19-16(11-15(12-22)21(26)27-3)20(25)24-9-5-4-6-18(24)23-19/h4-11H,1-3H3/b15-11+InChIKey
HVDMGQRAARBQBF-RVDMUPIBSA-NSynonyms
620110-10-3(E)methyl2cyano3(2(24dimethylphenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)acrylate
620110103
CC1=CC(=C(C=C1)OC2=C(C(=O)N3C=CC=CC3=N2)C=C(C#N)C(=O)OC)C
InChI=1SC21H17N3O4c1137817(14(2)1013)281916(1115(1222)21(26)273)20(25)24954618(24)2319h411H13H3b1511+
methyl(2E)2cyano3(2(24dimethylphenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)prop2enoate
METHYL(E)2CYANO3(2(24DIMETHYLPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENOATE
MFCD04161354
N#CC(=Cc1c(Oc2ccc(cc2C)C)nc2n(c1=O)cccc2)C(=O)OC
ZINC000004205525
ZINC4205525
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