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

Systemtic Name: (E)-3-[1-(4-bromanyl-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclohexyl-prop-2-enamide Openeye Name: (E)-3-[1-(4-bromo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclohexyl-prop-2-enamide CAS Name: (E)-3-[1-(4-bromo-3-methylphenyl)-2,5-dimethyl-3-pyrrolyl]-2-cyano-N-cyclohexyl-2-propenamide IUPAC Name: (E)-3-[1-(4-bromo-3-methylphenyl)-2,5-dimethylpyrrol-3-yl]-2-cyano-N-cyclohexylprop-2-enamide Traditional Name: (E)-3-[1-(4-bromo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-cyano-N-cyclohexyl-acrylamide Formula: C23H26BrN3O MolecularWeight: 440.37604

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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)NC3CCCCC3

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=C(C=C2)Br)C)C)/C=C(\C#N)/C(=O)NC3CCCCC3

InChI

InChI=1S/C23H26BrN3O/c1-15-11-21(9-10-22(15)24)27-16(2)12-18(17(27)3)13-19(14-25)23(28)26-20-7-5-4-6-8-20/h9-13,20H,4-8H2,1-3H3,(H,26,28)/b19-13+