(E)-2-cyano-N-(3-cyclopentylsulfonylphenyl)-3-(4-methylphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-cyclopentylsulfonylphenyl)-3-(4-methylphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(3-cyclopentylsulfonylphenyl)-3-(p-tolyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(3-cyclopentylsulfonylphenyl)-3-(4-methylphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-cyclopentylsulfonylphenyl)-3-(4-methylphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(3-cyclopentylsulfonylphenyl)-3-(p-tolyl)acrylamide Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=CC(=CC=C2)S(=O)(=O)C3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC(=CC=C2)S(=O)(=O)C3CCCC3

InChI

InChI=1S/C22H22N2O3S/c1-16-9-11-17(12-10-16)13-18(15-23)22(25)24-19-5-4-8-21(14-19)28(26,27)20-6-2-3-7-20/h4-5,8-14,20H,2-3,6-7H2,1H3,(H,24,25)/b18-13+