(E)-2-cyano-N-(3-cyclopentylsulfonylphenyl)-3-(3-methoxyphenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(3-cyclopentylsulfonylphenyl)-3-(3-methoxyphenyl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(3-cyclopentylsulfonylphenyl)-3-(3-methoxyphenyl)prop-2-enamide CAS Name: (E)-2-cyano-N-(3-cyclopentylsulfonylphenyl)-3-(3-methoxyphenyl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(3-cyclopentylsulfonylphenyl)-3-(3-methoxyphenyl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(3-cyclopentylsulfonylphenyl)-3-(3-methoxyphenyl)acrylamide Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=C(C#N)C(=O)NC2=CC(=CC=C2)S(=O)(=O)C3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)/C=C(\C#N)/C(=O)NC2=CC(=CC=C2)S(=O)(=O)C3CCCC3

InChI

InChI=1S/C22H22N2O4S/c1-28-19-8-4-6-16(13-19)12-17(15-23)22(25)24-18-7-5-11-21(14-18)29(26,27)20-9-2-3-10-20/h4-8,11-14,20H,2-3,9-10H2,1H3,(H,24,25)/b17-12+