(E)-3-[1-(4-bromanyl-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclopropyl-prop-2-enamide

Systemtic Name: (E)-3-[1-(4-bromanyl-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclopropyl-prop-2-enamide Openeye Name: (E)-3-[1-(4-bromo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclopropyl-prop-2-enamide CAS Name: (E)-3-[1-(4-bromo-3-methylphenyl)-2,5-dimethyl-3-pyrrolyl]-2-cyano-N-cyclopropyl-2-propenamide IUPAC Name: (E)-3-[1-(4-bromo-3-methylphenyl)-2,5-dimethylpyrrol-3-yl]-2-cyano-N-cyclopropylprop-2-enamide Traditional Name: (E)-3-[1-(4-bromo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclopropyl-acrylamide Formula: C20H20BrN3O MolecularWeight: 398.2963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=C(C=C2)Br)C)C)C=C(C#N)C(=O)NC3CC3

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=C(C=C2)Br)C)C)/C=C(\C#N)/C(=O)NC3CC3

InChI

InChI=1S/C20H20BrN3O/c1-12-8-18(6-7-19(12)21)24-13(2)9-15(14(24)3)10-16(11-22)20(25)23-17-4-5-17/h6-10,17H,4-5H2,1-3H3,(H,23,25)/b16-10+