(E)-2-cyano-3-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)-N-(3-ethanoylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)-N-(3-ethanoylphenyl)prop-2-enamide Openeye Name: (E)-N-(3-acetylphenyl)-2-cyano-3-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enamide CAS Name: (E)-N-(3-acetylphenyl)-2-cyano-3-(1-cyclohexyl-2,5-dimethyl-3-pyrrolyl)-2-propenamide IUPAC Name: (E)-N-(3-acetylphenyl)-2-cyano-3-(1-cyclohexyl-2,5-dimethylpyrrol-3-yl)prop-2-enamide Traditional Name: (E)-N-(3-acetylphenyl)-2-cyano-3-(1-cyclohexyl-2,5-dimethyl-pyrrol-3-yl)acrylamide Formula: C24H27N3O2 MolecularWeight: 389.49008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CCCCC2)C)C=C(C#N)C(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=CC(=C(N1C2CCCCC2)C)/C=C(\C#N)/C(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C24H27N3O2/c1-16-12-20(17(2)27(16)23-10-5-4-6-11-23)13-21(15-25)24(29)26-22-9-7-8-19(14-22)18(3)28/h7-9,12-14,23H,4-6,10-11H2,1-3H3,(H,26,29)/b21-13+