(E)-N-(4-acetamidophenyl)-3-[5-(4-bromophenyl)thiophen-2-yl]-2-cyano-prop-2-enamide

Systemtic Name: (E)-N-(4-acetamidophenyl)-3-[5-(4-bromophenyl)thiophen-2-yl]-2-cyano-prop-2-enamide Openeye Name: (E)-N-(4-acetamidophenyl)-3-[5-(4-bromophenyl)-2-thienyl]-2-cyano-prop-2-enamide CAS Name: (E)-N-(4-acetamidophenyl)-3-[5-(4-bromophenyl)-2-thiophenyl]-2-cyano-2-propenamide IUPAC Name: (E)-N-(4-acetamidophenyl)-3-[5-(4-bromophenyl)thiophen-2-yl]-2-cyanoprop-2-enamide Traditional Name: (E)-N-(4-acetamidophenyl)-3-[5-(4-bromophenyl)-2-thienyl]-2-cyano-acrylamide Formula: C22H16BrN3O2S MolecularWeight: 466.35034

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C(=CC2=CC=C(S2)C3=CC=C(C=C3)Br)C#N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)/C(=C/C2=CC=C(S2)C3=CC=C(C=C3)Br)/C#N

InChI

InChI=1S/C22H16BrN3O2S/c1-14(27)25-18-6-8-19(9-7-18)26-22(28)16(13-24)12-20-10-11-21(29-20)15-2-4-17(23)5-3-15/h2-12H,1H3,(H,25,27)(H,26,28)/b16-12+