Vitas-M small molecule compound

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

Catalog ID
STK903756
SMILES CCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1/C=C(/C(=O)Nc1ccc(cc1)C)\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 C26H28N6O2 MW 456.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N6O2/c1-4-30-12-14-31(15-13-30)24-22(26(34)32-11-5-6-19(3)23(32)29-24)16-20(17-27)25(33)28-21-9-7-18(2)8-10-21/h5-11,16H,4,12-15H2,1-3H3,(H,28,33)/b20-16+
InChIKey
LAPLLJBNDZXPBA-CAPFRKAQSA-N
Synonyms
799769-66-7
(2E)2cyano3(2(4ethylpiperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)N(4methylphenyl)prop2enamide
(E)2cyano3(2(4ethylpiperazin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)N(ptolyl)acrylamide
(E)2CYANO3(2(4ETHYLPIPERAZIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)N(4METHYLPHENYL)PROP2ENAMIDE
799769667
CCN1CCN(CC1)c1nc2c(C)cccn2c(=O)c1C=C(C(=O)Nc1ccc(cc1)C)C#N
CCN1CCN(CC1)C2=C(C(=O)N3C=CC=C(C3=N2)C)C=C(C#N)C(=O)NC4=CC=C(C=C4)C
InChI=1SC26H28N6O2c1430121431(151330)2422(26(34)32115619(3)23(32)2924)1620(1727)25(33)28219718(2)81021h51116H41215H213H3(H2833)b2016+
MFCD03671205
ZINC000013658781
ZINC13658781

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Available files

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