(E)-3-(3,5-dimethoxyphenyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(3,5-dimethoxyphenyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)prop-2-enamide Openeye Name: (E)-3-(3,5-dimethoxyphenyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)prop-2-enamide CAS Name: (E)-3-(3,5-dimethoxyphenyl)-N-[3-(1-pyrrolidinylsulfonyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(3,5-dimethoxyphenyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)prop-2-enamide Traditional Name: (E)-3-(3,5-dimethoxyphenyl)-N-(3-pyrrolidinosulfonylphenyl)acrylamide Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C=CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)/C=C/C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCC3)OC

InChI

InChI=1S/C21H24N2O5S/c1-27-18-12-16(13-19(15-18)28-2)8-9-21(24)22-17-6-5-7-20(14-17)29(25,26)23-10-3-4-11-23/h5-9,12-15H,3-4,10-11H2,1-2H3,(H,22,24)/b9-8+