Vitas-M small molecule compound
3-{(1E)-2-cyano-3-[(2-fluorophenyl)amino]-3-oxoprop-1-en-1-yl}phenyl naphthalene-1-carboxylate
Catalog ID
STK522763
SMILES N#C/C(=C\c1cccc(c1)OC(=O)c1cccc2c1cccc2)/C(=O)Nc1ccccc1F
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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 C27H17FN2O3 MW 436.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H17FN2O3/c28-24-13-3-4-14-25(24)30-26(31)20(17-29)15-18-7-5-10-21(16-18)33-27(32)23-12-6-9-19-8-1-2-11-22(19)23/h1-16H,(H,30,31)/b20-15+InChIKey
KIBIKTAUMKGMSF-HMMYKYKNSA-NSynonyms
(3((E)2CYANO3(2FLUOROANILINO)3OXOPROP1ENYL)PHENYL)NAPHTHALENE1CARBOXYLATE
3((1E)2cyano3((2fluorophenyl)amino)3oxoprop1en1yl)phenylnaphthalene1carboxylate
C1=CC=C2C(=C1)C=CC=C2C(=O)OC3=CC=CC(=C3)C=C(C#N)C(=O)NC4=CC=CC=C4F
InChI=1SC27H17FN2O3c282413341425(24)3026(31)20(1729)1518751021(1618)3327(32)231269198121122(19)23h116H(H3031)b2015+
MFCD03158097
N#CC(=Cc1cccc(c1)OC(=O)c1cccc2c1cccc2)C(=O)Nc1ccccc1F
ZINC000001439495
ZINC01439495
ZINC1439495
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