Vitas-M small molecule compound
N-{(1Z)-1-[1-cyano-2-oxo-2-(propylamino)ethylidene]-1H-isoindol-3-yl}-4-nitrobenzamide
Catalog ID
STK829181
SMILES CCCNC(=O)/C(=C/1\N=C(c2c1cccc2)NC(=O)c1ccc(cc1)[N+](=O)[O-])/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 C21H17N5O4 MW 403.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O4/c1-2-11-23-21(28)17(12-22)18-15-5-3-4-6-16(15)19(24-18)25-20(27)13-7-9-14(10-8-13)26(29)30/h3-10H,2,11H2,1H3,(H,23,28)(H,24,25,27)/b18-17-InChIKey
TVLYIZMPDFMDOO-ZCXUNETKSA-NSynonyms
892623-51-7(Z)N(1(1cyano2oxo2(propylamino)ethylidene)1Hisoindol3yl)4nitrobenzamide
892623517
CCCNC(=O)C(=C1C2=CC=CC=C2C(=N1)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O))C#N
CCCNC(=O)C(=C1N=C(c2c1cccc2)NC(=O)c1ccc(cc1)(N+)(=O)(O))C#N
InChI=1SC21H17N5O4c12112321(28)17(1222)1815534616(15)19(2418)2520(27)137914(10813)26(29)30h310H211H21H3(H2328)(H242527)b1817
MFCD06778328
N((1Z)1(1cyano2oxo2(propylamino)ethylidene)1Hisoindol3yl)4nitrobenzamide
N((3Z)3(1CYANO2OXO2(PROPYLAMINO)ETHYLIDENE)ISOINDOL1YL)4NITROBENZAMIDE
ZINC000005272701
ZINC05272701
ZINC5272701
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