Vitas-M small molecule compound
2,4-dichloro-N-{(1Z)-1-[1-cyano-2-(hexylamino)-2-oxoethylidene]-1H-isoindol-3-yl}benzamide
Catalog ID
STK991338
SMILES CCCCCCNC(=O)/C(=C/1\N=C(c2c1cccc2)NC(=O)c1ccc(cc1Cl)Cl)/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 C24H22Cl2N4O2 MW 469.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22Cl2N4O2/c1-2-3-4-7-12-28-23(31)19(14-27)21-16-8-5-6-9-17(16)22(29-21)30-24(32)18-11-10-15(25)13-20(18)26/h5-6,8-11,13H,2-4,7,12H2,1H3,(H,28,31)(H,29,30,32)/b21-19-InChIKey
MKWNLGHSPQJVMK-VZCXRCSSSA-NSynonyms
24dichloroN((1Z)1(1cyano2(hexylamino)2oxoethylidene)1Hisoindol3yl)benzamide
24dichloroN((3Z)3(1cyano2(hexylamino)2oxoethylidene)isoindol1yl)benzamide
CCCCCCNC(=O)C(=C1C2=CC=CC=C2C(=N1)NC(=O)C3=C(C=C(C=C3)Cl)Cl)C#N
CCCCCCNC(=O)C(=C1N=C(c2c1cccc2)NC(=O)c1ccc(cc1Cl)Cl)C#N
InChI=1SC24H22Cl2N4O2c12347122823(31)19(1427)2116856917(16)22(2921)3024(32)18111015(25)1320(18)26h5681113H24712H21H3(H2831)(H293032)b2119
MFCD07801914
ZINC000008836359
ZINC08836359
ZINC8836359
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