Vitas-M small molecule compound

methyl (2E)-3-[2-(4-carbamoylpiperidin-1-yl)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-2-cyanoprop-2-enoate

Catalog ID
STK905940
SMILES N#C/C(=C\c1c(nc2n(c1=O)cccc2C)N1CCC(CC1)C(=O)N)/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 C20H21N5O4 MW 395.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O4/c1-12-4-3-7-25-17(12)23-18(24-8-5-13(6-9-24)16(22)26)15(19(25)27)10-14(11-21)20(28)29-2/h3-4,7,10,13H,5-6,8-9H2,1-2H3,(H2,22,26)/b14-10+
InChIKey
CEFYVYHGWVKXFZ-GXDHUFHOSA-N
Synonyms
849923-55-3
(E)methyl3(2(4carbamoylpiperidin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoacrylate
849923553
CC1=CC=CN2C1=NC(=C(C2=O)C=C(C#N)C(=O)OC)N3CCC(CC3)C(=O)N
InChI=1SC20H21N5O4c1124372517(12)2318(248513(6924)16(22)26)15(19(25)27)1014(1121)20(28)292h3471013H5689H212H3(H22226)b1410+
methyl(2E)3(2(4carbamoylpiperidin1yl)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)2cyanoprop2enoate
METHYL(E)3(2(4CARBAMOYLPIPERIDIN1YL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)2CYANOPROP2ENOATE
MFCD03671881
N#CC(=Cc1c(nc2n(c1=O)cccc2C)N1CCC(CC1)C(=O)N)C(=O)OC
ZINC000002216717
ZINC2216717

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Available files

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