Vitas-M small molecule compound
1-(3-{(1E)-2-cyano-3-[(4-ethoxyphenyl)amino]-3-oxoprop-1-en-1-yl}-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)piperidine-4-carboxamide
Catalog ID
STK904642
SMILES CCOc1ccc(cc1)NC(=O)/C(=C/c1c(nc2n(c1=O)cccc2)N1CCC(CC1)C(=O)N)/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 C26H26N6O4 MW 486.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N6O4/c1-2-36-20-8-6-19(7-9-20)29-25(34)18(16-27)15-21-24(31-13-10-17(11-14-31)23(28)33)30-22-5-3-4-12-32(22)26(21)35/h3-9,12,15,17H,2,10-11,13-14H2,1H3,(H2,28,33)(H,29,34)/b18-15+InChIKey
KROYSAWUCGHTEK-OBGWFSINSA-NSynonyms
799770-24-4(E)1(3(2cyano3((4ethoxyphenyl)amino)3oxoprop1en1yl)4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxamide
1(3((1E)2cyano3((4ethoxyphenyl)amino)3oxoprop1en1yl)4oxo4Hpyrido(12a)pyrimidin2yl)piperidine4carboxamide
1(3((E)2CYANO3(4ETHOXYANILINO)3OXOPROP1ENYL)4OXOPYRIDO(12A)PYRIMIDIN2YL)PIPERIDINE4CARBOXAMIDE
799770244
CCOC1=CC=C(C=C1)NC(=O)C(=CC2=C(N=C3C=CC=CN3C2=O)N4CCC(CC4)C(=O)N)C#N
CCOc1ccc(cc1)NC(=O)C(=Cc1c(nc2n(c1=O)cccc2)N1CCC(CC1)C(=O)N)C#N
InChI=1SC26H26N6O4c1236208619(7920)2925(34)18(1627)152124(31131017(111431)23(28)33)30225341232(22)26(21)35h39121517H210111314H21H3(H22833)(H2934)b1815+
MFCD03671413
ZINC000002203886
ZINC2203886
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.