Vitas-M small molecule compound
(2E)-3-[(3-chloro-4-fluorophenyl)amino]-1-phenylbut-2-en-1-one
Catalog ID
STK082649
SMILES C/C(=C\C(=O)c1ccccc1)/Nc1ccc(c(c1)Cl)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 C16H13ClFNO MW 289.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClFNO/c1-11(9-16(20)12-5-3-2-4-6-12)19-13-7-8-15(18)14(17)10-13/h2-10,19H,1H3/b11-9+InChIKey
KUPOHYUVMVCKEO-PKNBQFBNSA-NSynonyms
(2E)3((3CHLORO4FLUOROPHENYL)AMINO)1PHENYLBUT2EN1ONE
(E)3(3CHLORO4FLUOROANILINO)1PHENYLBUT2EN1ONE
CC(=CC(=O)C1=CC=CC=C1)NC2=CC(=C(C=C2)F)Cl
CC(=CC(=O)c1ccccc1)Nc1ccc(c(c1)Cl)F
InChI=1SC16H13ClFNOc111(916(20)125324612)19137815(18)14(17)1013h21019H1H3b119+
MFCD02911802
STK082649
ZINC000017722143
ZINC17722143
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