Vitas-M small molecule compound
(2E)-1-(3,4-dimethylphenyl)-3-[(2-fluorophenyl)amino]prop-2-en-1-one
Catalog ID
STK902588
SMILES O=C(c1ccc(c(c1)C)C)/C=C/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 C17H16FNO MW 269.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16FNO/c1-12-7-8-14(11-13(12)2)17(20)9-10-19-16-6-4-3-5-15(16)18/h3-11,19H,1-2H3/b10-9+InChIKey
YXZUURVCGOFXQA-MDZDMXLPSA-NSynonyms
(2E)1(34dimethylphenyl)3((2fluorophenyl)amino)prop2en1one
(E)1(34dimethylphenyl)3(2fluoroanilino)prop2en1one
CC1=C(C=C(C=C1)C(=O)C=CNC2=CC=CC=C2F)C
InChI=1SC17H16FNOc1127814(1113(12)2)17(20)9101916643515(16)18h31119H12H3b109+
MFCD18175096
O=C(c1ccc(c(c1)C)C)C=CNc1ccccc1F
ZINC000044844033
ZINC44844033
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