Vitas-M small molecule compound
3-{[(2E)-2-cyano-3-{4-[(4-fluorobenzyl)oxy]phenyl}prop-2-enoyl]amino}benzoic acid
Catalog ID
STK522690
SMILES N#C/C(=C\c1ccc(cc1)OCc1ccc(cc1)F)/C(=O)Nc1cccc(c1)C(=O)O
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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 C24H17FN2O4 MW 416.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17FN2O4/c25-20-8-4-17(5-9-20)15-31-22-10-6-16(7-11-22)12-19(14-26)23(28)27-21-3-1-2-18(13-21)24(29)30/h1-13H,15H2,(H,27,28)(H,29,30)/b19-12+InChIKey
YOQISUXQHUFCLO-XDHOZWIPSA-NSynonyms
3(((2E)2cyano3(4((4fluorobenzyl)oxy)phenyl)prop2enoyl)amino)benzoicacid
3(((E)2CYANO3(4((4FLUOROPHENYL)METHOXY)PHENYL)1OXOPROP2ENYL)AMINO)BENZOICACID
3(((E)2CYANO3(4((4FLUOROPHENYL)METHOXY)PHENYL)PROP2ENOYL)AMINO)BENZOICACID
3(((E)2CYANO3(4(4FLUOROBENZYL)OXYPHENYL)ACRYLOYL)AMINO)BENZOICACID
C1=CC(=CC(=C1)NC(=O)C(=CC2=CC=C(C=C2)OCC3=CC=C(C=C3)F)C#N)C(=O)O
InChI=1SC24H17FN2O4c25208417(5920)15312210616(71122)1219(1426)23(28)272131218(1321)24(29)30h113H15H2(H2728)(H2930)b1912+
MFCD03154988
N#CC(=Cc1ccc(cc1)OCc1ccc(cc1)F)C(=O)Nc1cccc(c1)C(=O)O
ZINC000001438747
ZINC1438747
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