(E)-N-[(2-bromanyl-4-methyl-phenyl)carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide

Systemtic Name: (E)-N-[(2-bromanyl-4-methyl-phenyl)carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide Openeye Name: (E)-N-[(2-bromo-4-methyl-phenyl)carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide CAS Name: (E)-N-[(2-bromo-4-methylanilino)-sulfanylidenemethyl]-3-(4-fluorophenyl)-2-propenamide IUPAC Name: (E)-N-[(2-bromo-4-methylphenyl)carbamothioyl]-3-(4-fluorophenyl)prop-2-enamide Traditional Name: (E)-N-[(2-bromo-4-methyl-phenyl)thiocarbamoyl]-3-(4-fluorophenyl)acrylamide Formula: C17H14BrFN2OS MolecularWeight: 393.273263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NC(=O)C=CC2=CC=C(C=C2)F)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NC(=O)/C=C/C2=CC=C(C=C2)F)Br

InChI

InChI=1S/C17H14BrFN2OS/c1-11-2-8-15(14(18)10-11)20-17(23)21-16(22)9-5-12-3-6-13(19)7-4-12/h2-10H,1H3,(H2,20,21,22,23)/b9-5+