Vitas-M small molecule compound
(2E)-2-cyano-N-(3-methoxypropyl)-3-{2-[5-methyl-2-(propan-2-yl)phenoxy]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}prop-2-enamide
Catalog ID
STK817739
SMILES COCCCNC(=O)/C(=C/c1c(Oc2cc(C)ccc2C(C)C)nc2n(c1=O)cccc2)/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 C26H28N4O4 MW 460.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O4/c1-17(2)20-10-9-18(3)14-22(20)34-25-21(26(32)30-12-6-5-8-23(30)29-25)15-19(16-27)24(31)28-11-7-13-33-4/h5-6,8-10,12,14-15,17H,7,11,13H2,1-4H3,(H,28,31)/b19-15+InChIKey
BXBIXDAUZZINEC-XDJHFCHBSA-NSynonyms
620108-36-3(2E)2cyanoN(3methoxypropyl)3(2(5methyl2(propan2yl)phenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)prop2enamide
(E)2cyano3(2(2isopropyl5methylphenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)N(3methoxypropyl)acrylamide
(E)2CYANON(3METHOXYPROPYL)3(2(5METHYL2PROPAN2YLPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENAMIDE
620108363
CC1=CC(=C(C=C1)C(C)C)OC2=C(C(=O)N3C=CC=CC3=N2)C=C(C#N)C(=O)NCCCOC
COCCCNC(=O)C(=Cc1c(Oc2cc(C)ccc2C(C)C)nc2n(c1=O)cccc2)C#N
InChI=1SC26H28N4O4c117(2)2010918(3)1422(20)342521(26(32)301265823(30)2925)1519(1627)24(31)2811713334h5681012141517H71113H214H3(H2831)b1915+
MFCD05706303
ZINC000013811516
ZINC13811516
Check stock
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Check stock on Vitas-MAvailable files
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