Vitas-M small molecule compound

N-{(1Z)-1-[1-cyano-2-oxo-2-(propylamino)ethylidene]-1H-isoindol-3-yl}-3,4-dimethoxybenzamide

Catalog ID
STK829187
SMILES CCCNC(=O)/C(=C/1\N=C(c2c1cccc2)NC(=O)c1ccc(c(c1)OC)OC)/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 C23H22N4O4 MW 418.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O4/c1-4-11-25-23(29)17(13-24)20-15-7-5-6-8-16(15)21(26-20)27-22(28)14-9-10-18(30-2)19(12-14)31-3/h5-10,12H,4,11H2,1-3H3,(H,25,29)(H,26,27,28)/b20-17-
InChIKey
HBGBIGNPILHPSV-JZJYNLBNSA-N
Synonyms
885186-29-8
(Z)N(1(1cyano2oxo2(propylamino)ethylidene)1Hisoindol3yl)34dimethoxybenzamide
885186298
CCCNC(=O)C(=C1C2=CC=CC=C2C(=N1)NC(=O)C3=CC(=C(C=C3)OC)OC)C#N
CCCNC(=O)C(=C1N=C(c2c1cccc2)NC(=O)c1ccc(c(c1)OC)OC)C#N
InChI=1SC23H22N4O4c14112523(29)17(1324)2015756816(15)21(2620)2722(28)1491018(302)19(1214)313h51012H411H213H3(H2529)(H262728)b2017
MFCD06774296
N((1Z)1(1cyano2oxo2(propylamino)ethylidene)1Hisoindol3yl)34dimethoxybenzamide
N((3Z)3(1CYANO2OXO2(PROPYLAMINO)ETHYLIDENE)ISOINDOL1YL)34DIMETHOXYBENZAMIDE
ZINC000005245332
ZINC05245332
ZINC5245332

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Available files

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