Vitas-M small molecule compound

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

Catalog ID
STK991751
SMILES N#CC1=C(C)/C(=C/Nc2cccc(c2)OC)/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/c1-16-21(13-26)24(30)29(11-10-17-14-28-23-9-4-3-8-20(17)23)25(31)22(16)15-27-18-6-5-7-19(12-18)32-2/h3-9,12,14-15,27-28H,10-11H2,1-2H3/b22-15-
InChIKey
QVTDNBQBEQPPRQ-JCMHNJIXSA-N
Synonyms

(5Z)1(2(1Hindol3yl)ethyl)5(((3methoxyphenyl)amino)methylidene)4methyl26dioxo1256tetrahydropyridine3carbonitrile
(5Z)1(2(1Hindol3yl)ethyl)5((3methoxyanilino)methylidene)4methyl26dioxopyridine3carbonitrile
(Z)1(2(1Hindol3yl)ethyl)5(((3methoxyphenyl)amino)methylene)4methyl26dioxo1256tetrahydropyridine3carbonitrile
CC1=C(C(=O)N(C(=O)C1=CNC2=CC(=CC=C2)OC)CCC3=CNC4=CC=CC=C43)C#N
InChI=1SC25H22N4O3c11621(1326)24(30)29(111017142823943820(17)23)25(31)22(16)15271865719(1218)322h391214152728H1011H212H3b2215
MFCD09846072
N#CC1=C(C)C(=CNc2cccc(c2)OC)C(=O)N(C1=O)CCc1c(nH)c2c1cccc2
ZINC000009423020
ZINC09423020
ZINC9423020

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Available files

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