Vitas-M small molecule compound
methyl 4-({(1Z)-2-cyano-3-[(4-fluorophenyl)amino]-3-oxoprop-1-en-1-yl}amino)benzoate
Catalog ID
STK715979
SMILES COC(=O)c1ccc(cc1)N/C=C(\C(=O)Nc1ccc(cc1)F)/C#N
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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 C18H14FN3O3 MW 339.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14FN3O3/c1-25-18(24)12-2-6-15(7-3-12)21-11-13(10-20)17(23)22-16-8-4-14(19)5-9-16/h2-9,11,21H,1H3,(H,22,23)/b13-11-InChIKey
GIFNEIQGKGZYSE-QBFSEMIESA-NSynonyms
(E)methyl4((2cyano3((4fluorophenyl)amino)3oxoprop1en1yl)amino)benzoate
COC(=O)C1=CC=C(C=C1)NC=C(C#N)C(=O)NC2=CC=C(C=C2)F
COC(=O)c1ccc(cc1)NC=C(C(=O)Nc1ccc(cc1)F)C#N
InChI=1SC18H14FN3O3c12518(24)122615(7312)211113(1020)17(23)22168414(19)5916h291121H1H3(H2223)b1311
methyl4(((1Z)2cyano3((4fluorophenyl)amino)3oxoprop1en1yl)amino)benzoate
methyl4(((Z)2cyano3(4fluoroanilino)3oxoprop1enyl)amino)benzoate
MFCD08166871
ZINC000011692037
ZINC11692037
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