(Z)-3-[1-(4-bromophenyl)pyrrol-2-yl]-2-cyano-N-(phenylmethyl)prop-2-enamide

Systemtic Name: (Z)-3-[1-(4-bromophenyl)pyrrol-2-yl]-2-cyano-N-(phenylmethyl)prop-2-enamide Openeye Name: (Z)-N-benzyl-3-[1-(4-bromophenyl)pyrrol-2-yl]-2-cyano-prop-2-enamide CAS Name: (Z)-3-[1-(4-bromophenyl)-2-pyrrolyl]-2-cyano-N-(phenylmethyl)-2-propenamide IUPAC Name: (Z)-N-benzyl-3-[1-(4-bromophenyl)pyrrol-2-yl]-2-cyanoprop-2-enamide Traditional Name: (Z)-N-benzyl-3-[1-(4-bromophenyl)pyrrol-2-yl]-2-cyano-acrylamide Formula: C21H16BrN3O MolecularWeight: 406.27524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(=CC2=CC=CN2C3=CC=C(C=C3)Br)C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)/C(=C\C2=CC=CN2C3=CC=C(C=C3)Br)/C#N

InChI

InChI=1S/C21H16BrN3O/c22-18-8-10-19(11-9-18)25-12-4-7-20(25)13-17(14-23)21(26)24-15-16-5-2-1-3-6-16/h1-13H,15H2,(H,24,26)/b17-13-