Vitas-M small molecule compound
ethyl 1-{3-[(1E)-2-cyano-3-(ethylamino)-3-oxoprop-1-en-1-yl]-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}piperidine-4-carboxylate
Catalog ID
STK906228
SMILES CCNC(=O)/C(=C/c1c(nc2n(c1=O)cccc2C)N1CCC(CC1)C(=O)OCC)/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 C23H27N5O4 MW 437.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5O4/c1-4-25-21(29)17(14-24)13-18-20(26-19-15(3)7-6-10-28(19)22(18)30)27-11-8-16(9-12-27)23(31)32-5-2/h6-7,10,13,16H,4-5,8-9,11-12H2,1-3H3,(H,25,29)/b17-13+InChIKey
LBIVWHYYYKADLZ-GHRIWEEISA-NSynonyms
850192-71-1(E)ethyl1(3(2cyano3(ethylamino)3oxoprop1en1yl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxylate
850192711
CCNC(=O)C(=CC1=C(N=C2C(=CC=CN2C1=O)C)N3CCC(CC3)C(=O)OCC)C#N
CCNC(=O)C(=Cc1c(nc2n(c1=O)cccc2C)N1CCC(CC1)C(=O)OCC)C#N
ethyl1(3((1E)2cyano3(ethylamino)3oxoprop1en1yl)9methyl4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxylate
ETHYL1(3((E)2CYANO3(ETHYLAMINO)3OXOPROP1ENYL)9METHYL4OXOPYRIDO(12A)PYRIMIDIN2YL)PIPERIDINE4CARBOXYLATE
InChI=1SC23H27N5O4c142521(29)17(1424)131820(261915(3)761028(19)22(18)30)2711816(91227)23(31)3252h67101316H45891112H213H3(H2529)b1713+
MFCD03671519
ZINC000002329279
ZINC2329279
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