Vitas-M small molecule compound
3-bromo-N-[(1Z)-1-{1-cyano-2-[(furan-2-ylmethyl)amino]-2-oxoethylidene}-1H-isoindol-3-yl]benzamide
Catalog ID
STK991324
SMILES N#C/C(=C\1/N=C(c2c1cccc2)NC(=O)c1cccc(c1)Br)/C(=O)NCc1ccco1
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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 C23H15BrN4O3 MW 475.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15BrN4O3/c24-15-6-3-5-14(11-15)22(29)28-21-18-9-2-1-8-17(18)20(27-21)19(12-25)23(30)26-13-16-7-4-10-31-16/h1-11H,13H2,(H,26,30)(H,27,28,29)/b20-19-InChIKey
PBIBQLKGINWYNS-VXPUYCOJSA-NSynonyms
3bromoN((1Z)1(1cyano2((furan2ylmethyl)amino)2oxoethylidene)1Hisoindol3yl)benzamide
3bromoN((3Z)3(1cyano2(furan2ylmethylamino)2oxoethylidene)isoindol1yl)benzamide
C1=CC=C2C(=C1)C(=C(C#N)C(=O)NCC3=CC=CO3)N=C2NC(=O)C4=CC(=CC=C4)Br
InChI=1SC23H15BrN4O3c241563514(1115)22(29)282118921817(18)20(2721)19(1225)23(30)26131674103116h111H13H2(H2630)(H272829)b2019
MFCD08166928
N#CC(=C1N=C(c2c1cccc2)NC(=O)c1cccc(c1)Br)C(=O)NCc1ccco1
ZINC000011692104
ZINC11692104
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