Vitas-M small molecule compound

(5Z)-1-[2-(1H-indol-3-yl)ethyl]-5-{[(2-methoxyphenyl)amino]methylidene}-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile

Catalog ID
STK719281
SMILES N#CC1=C(C)/C(=C/Nc2ccccc2OC)/C(=O)N(C1=O)CCc1c[nH]c2c1cccc2

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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 C25H22N4O3 MW 426.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O3/c1-16-19(13-26)24(30)29(12-11-17-14-27-21-8-4-3-7-18(17)21)25(31)20(16)15-28-22-9-5-6-10-23(22)32-2/h3-10,14-15,27-28H,11-12H2,1-2H3/b20-15-
InChIKey
IRMPCMHVBXJKMG-HKWRFOASSA-N
Synonyms

(5Z)1(2(1Hindol3yl)ethyl)5(((2methoxyphenyl)amino)methylidene)4methyl26dioxo1256tetrahydropyridine3carbonitrile
(5Z)1(2(1Hindol3yl)ethyl)5((2methoxyanilino)methylidene)4methyl26dioxopyridine3carbonitrile
(Z)1(2(1Hindol3yl)ethyl)5(((2methoxyphenyl)amino)methylene)4methyl26dioxo1256tetrahydropyridine3carbonitrile
CC1=C(C(=O)N(C(=O)C1=CNC2=CC=CC=C2OC)CCC3=CNC4=CC=CC=C43)C#N
InChI=1SC25H22N4O3c11619(1326)24(30)29(121117142721843718(17)21)25(31)20(16)1528229561023(22)322h31014152728H1112H212H3b2015
MFCD09794096
N#CC1=C(C)C(=CNc2ccccc2OC)C(=O)N(C1=O)CCc1c(nH)c2c1cccc2
ZINC000009423886
ZINC09423886
ZINC9423886

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Available files

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