Vitas-M small molecule compound
(5Z)-5-[(1,3-benzodioxol-5-ylamino)methylidene]-1-[2-(1H-indol-3-yl)ethyl]-4-methyl-2,6-dioxo-1,2,5,6-tetrahydropyridine-3-carbonitrile
Catalog ID
STK991744
SMILES N#CC1=C(C)/C(=C/Nc2ccc3c(c2)OCO3)/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 C25H20N4O4 MW 440.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N4O4/c1-15-19(11-26)24(30)29(9-8-16-12-28-21-5-3-2-4-18(16)21)25(31)20(15)13-27-17-6-7-22-23(10-17)33-14-32-22/h2-7,10,12-13,27-28H,8-9,14H2,1H3/b20-13-InChIKey
XCHITYACACUNPF-MOSHPQCFSA-NSynonyms
(5Z)5((13benzodioxol5ylamino)methylidene)1(2(1Hindol3yl)ethyl)4methyl26dioxo1256tetrahydropyridine3carbonitrile
(5Z)5((13benzodioxol5ylamino)methylidene)1(2(1Hindol3yl)ethyl)4methyl26dioxopyridine3carbonitrile
(Z)1(2(1Hindol3yl)ethyl)5((benzo(d)(13)dioxol5ylamino)methylene)4methyl26dioxo1256tetrahydropyridine3carbonitrile
CC1=C(C(=O)N(C(=O)C1=CNC2=CC3=C(C=C2)OCO3)CCC4=CNC5=CC=CC=C54)C#N
InChI=1SC25H20N4O4c11519(1126)24(30)29(9816122821532418(16)21)25(31)20(15)132717672223(1017)33143222h271012132728H8914H21H3b2013
MFCD09844365
N#CC1=C(C)C(=CNc2ccc3c(c2)OCO3)C(=O)N(C1=O)CCc1c(nH)c2c1cccc2
ZINC000009421920
ZINC09421920
ZINC9421920
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