Vitas-M small molecule compound
4-chloro-N-[(1Z)-1-{1-cyano-2-[(2-methylpropyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]benzamide
Catalog ID
STK578822
SMILES N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1ccc(cc1)Cl)/C(=O)NCC(C)C
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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 C22H19ClN4O2 MW 406.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O2/c1-13(2)12-25-22(29)18(11-24)19-16-5-3-4-6-17(16)20(26-19)27-21(28)14-7-9-15(23)10-8-14/h3-10,13H,12H2,1-2H3,(H,25,29)(H,26,27,28)/b19-18-InChIKey
OVBGTHKDKZCOKI-HNENSFHCSA-NSynonyms
900297-77-0(Z)4chloroN(1(1cyano2(isobutylamino)2oxoethylidene)1Hisoindol3yl)benzamide
4chloroN((1Z)1(1cyano2((2methylpropyl)amino)2oxoethylidene)1Hisoindol3yl)benzamide
4CHLORON((3Z)3(1CYANO2(2METHYLPROPYLAMINO)2OXOETHYLIDENE)ISOINDOL1YL)BENZAMIDE
900297770
CC(C)CNC(=O)C(=C1C2=CC=CC=C2C(=N1)NC(=O)C3=CC=C(C=C3)Cl)C#N
InChI=1SC22H19ClN4O2c113(2)122522(29)18(1124)1916534617(16)20(2619)2721(28)147915(23)10814h31013H12H212H3(H2529)(H262728)b1918
MFCD06770850
N#CC(=C1N=C(c2c1cccc2)NC(=O)c1ccc(cc1)Cl)C(=O)NCC(C)C
ZINC000005203792
ZINC05203792
ZINC5203792
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