(4E)-4-[[(3-fluorophenyl)methylamino]-sulfanyl-methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-[[(3-fluorophenyl)methylamino]-sulfanyl-methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one Openeye Name: (4E)-4-[[(3-fluorophenyl)methylamino]-sulfanyl-methylene]-2-methoxy-cyclohexa-2,5-dien-1-one CAS Name: (4E)-4-[[(3-fluorophenyl)methylamino]-mercaptomethylidene]-2-methoxy-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-4-[[(3-fluorophenyl)methylamino]-sulfanylmethylidene]-2-methoxycyclohexa-2,5-dien-1-one Traditional Name: (4E)-4-[[(3-fluorobenzyl)amino]-mercapto-methylene]-2-methoxy-cyclohexa-2,5-dien-1-one Formula: C15H14FNO2S MolecularWeight: 291.340563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(NCC2=CC(=CC=C2)F)S)C=CC1=O

Isomeric SMILES

COC1=C/C(=C(\NCC2=CC(=CC=C2)F)/S)/C=CC1=O

InChI

InChI=1S/C15H14FNO2S/c1-19-14-8-11(5-6-13(14)18)15(20)17-9-10-3-2-4-12(16)7-10/h2-8,17,20H,9H2,1H3/b15-11+