3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-methyl-prop-2-enamide

Systemtic Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-methyl-prop-2-enamide Openeye Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-methyl-prop-2-enamide CAS Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-3-pyrrolyl]-2-cyano-N-methyl-2-propenamide IUPAC Name: 3-[1-(4-bromophenyl)-2,5-dimethylpyrrol-3-yl]-2-cyano-N-methylprop-2-enamide Traditional Name: 3-[1-(4-bromophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-methyl-acrylamide Formula: C17H16BrN3O MolecularWeight: 358.23244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C=C(C#N)C(=O)NC

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)Br)C)C=C(C#N)C(=O)NC

InChI

InChI=1S/C17H16BrN3O/c1-11-8-13(9-14(10-19)17(22)20-3)12(2)21(11)16-6-4-15(18)5-7-16/h4-9H,1-3H3,(H,20,22)