Vitas-M small molecule compound
(2E)-3-[(5-chloro-2-fluorophenyl)amino]-1-[4-(propan-2-yl)phenyl]prop-2-en-1-one
Catalog ID
STK987082
SMILES Clc1ccc(c(c1)N/C=C/C(=O)c1ccc(cc1)C(C)C)F
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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 C18H17ClFNO MW 317.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17ClFNO/c1-12(2)13-3-5-14(6-4-13)18(22)9-10-21-17-11-15(19)7-8-16(17)20/h3-12,21H,1-2H3/b10-9+InChIKey
IFXYJMLGZAQIOB-MDZDMXLPSA-NSynonyms
(2E)3((5chloro2fluorophenyl)amino)1(4(propan2yl)phenyl)prop2en1one
(E)3(5chloro2fluoroanilino)1(4propan2ylphenyl)prop2en1one
CC(C)C1=CC=C(C=C1)C(=O)C=CNC2=C(C=CC(=C2)Cl)F
Clc1ccc(c(c1)NC=CC(=O)c1ccc(cc1)C(C)C)F
InChI=1SC18H17ClFNOc112(2)133514(6413)18(22)91021171115(19)7816(17)20h31221H12H3b109+
MFCD18183935
ZINC000051318747
ZINC51318747
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