(E)-N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enamide

Systemtic Name: (E)-N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-3-(5-bromanyl-2-fluoranyl-phenyl)prop-2-enamide Openeye Name: (E)-N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-3-(5-bromo-2-fluoro-phenyl)prop-2-enamide CAS Name: (E)-N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-3-(5-bromo-2-fluorophenyl)-2-propenamide IUPAC Name: (E)-N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-3-(5-bromo-2-fluorophenyl)prop-2-enamide Traditional Name: (E)-N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-3-(5-bromo-2-fluoro-phenyl)acrylamide Formula: C17H14BrFN2O2S MolecularWeight: 409.272663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C=CC2=C(C=CC(=C2)Br)F)SCC(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)/C=C/C2=C(C=CC(=C2)Br)F)SCC(=O)N

InChI

InChI=1S/C17H14BrFN2O2S/c18-12-6-7-13(19)11(9-12)5-8-17(23)21-14-3-1-2-4-15(14)24-10-16(20)22/h1-9H,10H2,(H2,20,22)(H,21,23)/b8-5+