2-cyano-N-(2,6-dimethylphenyl)-3-[4-[ethyl-(phenylmethyl)amino]phenyl]prop-2-enamide

Systemtic Name: 2-cyano-N-(2,6-dimethylphenyl)-3-[4-[ethyl-(phenylmethyl)amino]phenyl]prop-2-enamide Openeye Name: 3-[4-[benzyl(ethyl)amino]phenyl]-2-cyano-N-(2,6-dimethylphenyl)prop-2-enamide CAS Name: 2-cyano-N-(2,6-dimethylphenyl)-3-[4-[ethyl-(phenylmethyl)amino]phenyl]-2-propenamide IUPAC Name: 3-[4-[benzyl(ethyl)amino]phenyl]-2-cyano-N-(2,6-dimethylphenyl)prop-2-enamide Traditional Name: 3-[4-[benzyl(ethyl)amino]phenyl]-2-cyano-N-(2,6-dimethylphenyl)acrylamide Formula: C27H27N3O MolecularWeight: 409.52278

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C=C(C#N)C(=O)NC3=C(C=CC=C3C)C

Isomeric SMILES

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C=C(C#N)C(=O)NC3=C(C=CC=C3C)C

InChI

InChI=1S/C27H27N3O/c1-4-30(19-23-11-6-5-7-12-23)25-15-13-22(14-16-25)17-24(18-28)27(31)29-26-20(2)9-8-10-21(26)3/h5-17H,4,19H2,1-3H3,(H,29,31)