Vitas-M small molecule compound
5-{(1E)-2-cyano-3-[(2-fluorophenyl)amino]-3-oxoprop-1-en-1-yl}-2-methoxyphenyl 4-methoxybenzoate
Catalog ID
STK362075
SMILES N#C/C(=C\c1ccc(c(c1)OC(=O)c1ccc(cc1)OC)OC)/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 C25H19FN2O5 MW 446.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19FN2O5/c1-31-19-10-8-17(9-11-19)25(30)33-23-14-16(7-12-22(23)32-2)13-18(15-27)24(29)28-21-6-4-3-5-20(21)26/h3-14H,1-2H3,(H,28,29)/b18-13+InChIKey
YJKFEUXTHZOPKZ-QGOAFFKASA-NSynonyms
380566-67-6(5((E)2CYANO3(2FLUOROANILINO)3OXOPROP1ENYL)2METHOXYPHENYL)4METHOXYBENZOATE
380566676
5((1E)2CYANO3((2FLUOROPHENYL)AMINO)3OXOPROP1EN1YL)2METHOXYPHENYL4METHOXYBENZOATE
COC1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)C=C(C#N)C(=O)NC3=CC=CC=C3F)OC
InChI=1SC25H19FN2O5c1311910817(91119)25(30)33231416(71222(23)322)1318(1527)24(29)2821643520(21)26h314H12H3(H2829)b1813+
MFCD02915013
N#CC(=Cc1ccc(c(c1)OC(=O)c1ccc(cc1)OC)OC)C(=O)Nc1ccccc1F
ZINC000012590269
ZINC12590269
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