(E)-3-(3-fluoranyl-4-methoxy-phenyl)-N-(2-phenylsulfanylethyl)prop-2-enamide

Systemtic Name: (E)-3-(3-fluoranyl-4-methoxy-phenyl)-N-(2-phenylsulfanylethyl)prop-2-enamide Openeye Name: (E)-3-(3-fluoro-4-methoxy-phenyl)-N-(2-phenylsulfanylethyl)prop-2-enamide CAS Name: (E)-3-(3-fluoro-4-methoxyphenyl)-N-[2-(phenylthio)ethyl]-2-propenamide IUPAC Name: (E)-3-(3-fluoro-4-methoxyphenyl)-N-(2-phenylsulfanylethyl)prop-2-enamide Traditional Name: (E)-3-(3-fluoro-4-methoxy-phenyl)-N-[2-(phenylthio)ethyl]acrylamide Formula: C18H18FNO2S MolecularWeight: 331.404423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NCCSC2=CC=CC=C2)F

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NCCSC2=CC=CC=C2)F

InChI

InChI=1S/C18H18FNO2S/c1-22-17-9-7-14(13-16(17)19)8-10-18(21)20-11-12-23-15-5-3-2-4-6-15/h2-10,13H,11-12H2,1H3,(H,20,21)/b10-8+