Vitas-M small molecule compound

(2E)-2-cyano-N-(2-methoxyethyl)-3-{2-[5-methyl-2-(propan-2-yl)phenoxy]-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl}prop-2-enamide

Catalog ID
STK817743
SMILES COCCNC(=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 C25H26N4O4 MW 446.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O4/c1-16(2)19-9-8-17(3)13-21(19)33-24-20(14-18(15-26)23(30)27-10-12-32-4)25(31)29-11-6-5-7-22(29)28-24/h5-9,11,13-14,16H,10,12H2,1-4H3,(H,27,30)/b18-14+
InChIKey
IGDAVTBTFLWPNH-NBVRZTHBSA-N
Synonyms
620108-37-4
(2E)2cyanoN(2methoxyethyl)3(2(5methyl2(propan2yl)phenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)prop2enamide
(E)2cyano3(2(2isopropyl5methylphenoxy)4oxo4Hpyrido(12a)pyrimidin3yl)N(2methoxyethyl)acrylamide
(E)2CYANON(2METHOXYETHYL)3(2(5METHYL2PROPAN2YLPHENOXY)4OXOPYRIDO(12A)PYRIMIDIN3YL)PROP2ENAMIDE
620108374
CC1=CC(=C(C=C1)C(C)C)OC2=C(C(=O)N3C=CC=CC3=N2)C=C(C#N)C(=O)NCCOC
COCCNC(=O)C(=Cc1c(Oc2cc(C)ccc2C(C)C)nc2n(c1=O)cccc2)C#N
InChI=1SC25H26N4O4c116(2)199817(3)1321(19)332420(1418(1526)23(30)271012324)25(31)291165722(29)2824h5911131416H1012H214H3(H2730)b1814+
MFCD04447547
ZINC000013810705
ZINC13810705

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Available files

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