Vitas-M small molecule compound

(2E)-2-cyano-3-[2-(2,3-dimethylphenoxy)-9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]-N-(3-ethoxypropyl)prop-2-enamide

Catalog ID
STK705522
SMILES CCOCCCNC(=O)/C(=C/c1c(Oc2cccc(c2C)C)nc2n(c1=O)cccc2C)/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/c1-5-33-14-8-12-28-24(31)20(16-27)15-21-25(34-22-11-6-9-17(2)19(22)4)29-23-18(3)10-7-13-30(23)26(21)32/h6-7,9-11,13,15H,5,8,12,14H2,1-4H3,(H,28,31)/b20-15+
InChIKey
QCSJONGYGNHKGC-HMMYKYKNSA-N
Synonyms
620537-68-0
(2E)2cyano3(2(23dimethylphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)N(3ethoxypropyl)prop2enamide
(E)2cyano3(2(23dimethylphenoxy)9methyl4oxo4Hpyrido(12a)pyrimidin3yl)N(3ethoxypropyl)acrylamide
(E)2CYANO3(2(23DIMETHYLPHENOXY)9METHYL4OXOPYRIDO(12A)PYRIMIDIN3YL)N(3ETHOXYPROPYL)PROP2ENAMIDE
620537680
CCOCCCNC(=O)C(=CC1=C(N=C2C(=CC=CN2C1=O)C)OC3=CC=CC(=C3C)C)C#N
CCOCCCNC(=O)C(=Cc1c(Oc2cccc(c2C)C)nc2n(c1=O)cccc2C)C#N
InChI=1SC26H28N4O4c1533148122824(31)20(1627)152125(3422116917(2)19(22)4)292318(3)1071330(23)26(21)32h679111315H581214H214H3(H2831)b2015+
MFCD04174103
ZINC000002429688
ZINC2429688

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Available files

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