Vitas-M small molecule compound
3-[(1E)-2-cyano-3-oxo-3-(phenylamino)prop-1-en-1-yl]phenyl 3-fluorobenzoate
Catalog ID
STK098612
SMILES N#C/C(=C\c1cccc(c1)OC(=O)c1cccc(c1)F)/C(=O)Nc1ccccc1
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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 C23H15FN2O3 MW 386.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H15FN2O3/c24-19-8-5-7-17(14-19)23(28)29-21-11-4-6-16(13-21)12-18(15-25)22(27)26-20-9-2-1-3-10-20/h1-14H,(H,26,27)/b18-12+InChIKey
DFTCOQIZLNOGGY-LDADJPATSA-NSynonyms
404381-94-8(3((E)3ANILINO2CYANO3OXOPROP1ENYL)PHENYL)3FLUOROBENZOATE
3((1E)2CYANO3OXO3(PHENYLAMINO)PROP1EN1YL)PHENYL3FLUOROBENZOATE
404381948
C1=CC=C(C=C1)NC(=O)C(=CC2=CC(=CC=C2)OC(=O)C3=CC(=CC=C3)F)C#N
InChI=1SC23H15FN2O3c241985717(1419)23(28)2921114616(1321)1218(1525)22(27)262092131020h114H(H2627)b1812+
MFCD02604690
N#CC(=Cc1cccc(c1)OC(=O)c1cccc(c1)F)C(=O)Nc1ccccc1
STK098612
ZINC000002726874
ZINC02726874
ZINC2726874
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