Vitas-M small molecule compound

(2E)-2-cyano-3-[2-(2,3-dimethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-(prop-2-en-1-yl)prop-2-enamide

Catalog ID
STK817330
SMILES C=CCNC(=O)/C(=C/c1c(Oc2cccc(c2C)C)nc2n(c1=O)cccc2C)/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 C24H22N4O3 MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O3/c1-5-11-26-22(29)18(14-25)13-19-23(31-20-10-6-8-15(2)17(20)4)27-21-16(3)9-7-12-28(21)24(19)30/h5-10,12-13H,1,11H2,2-4H3,(H,26,29)/b18-13+
InChIKey
MKUNOVINRTXZCB-QGOAFFKASA-N
Synonyms
620537-46-4
(2E)2cyano3(2(23dimethylphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)N(prop2en1yl)prop2enamide
(2E)3(2(23DIMETHYLPHENOXY)9METHYL4OXO(5HYDROPYRIDINO(12A)PYRIMIDIN3YL))2CYANONPROP2ENYLPROP2ENAMIDE
(E)2CYANO3(2(23DIMETHYLPHENOXY)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)NPROP2ENYLPROP2ENAMIDE
(E)Nallyl2cyano3(2(23dimethylphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)acrylamide
620537464
C=CCNC(=O)C(=Cc1c(Oc2cccc(c2C)C)nc2n(c1=O)cccc2C)C#N
CC1=C(C(=CC=C1)OC2=C(C(=O)N3C=CC=C(C3=N2)C)C=C(C#N)C(=O)NCC=C)C
InChI=1SC24H22N4O3c15112622(29)18(1425)131923(3120106815(2)17(20)4)272116(3)971228(21)24(19)30h5101213H111H224H3(H2629)b1813+
MFCD04188183
ZINC000004205682
ZINC4205682

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.