4-[(E)-3-(2,4-dimethoxy-5-pyrrolidin-1-yl-phenyl)prop-2-enoyl]-N-(3-imidazol-1-ylpropyl)benzenesulfonamide

Systemtic Name: 4-[(E)-3-(2,4-dimethoxy-5-pyrrolidin-1-yl-phenyl)prop-2-enoyl]-N-(3-imidazol-1-ylpropyl)benzenesulfonamide Openeye Name: 4-[(E)-3-(2,4-dimethoxy-5-pyrrolidin-1-yl-phenyl)prop-2-enoyl]-N-(3-imidazol-1-ylpropyl)benzenesulfonamide CAS Name: 4-[(E)-3-[2,4-dimethoxy-5-(1-pyrrolidinyl)phenyl]-1-oxoprop-2-enyl]-N-[3-(1-imidazolyl)propyl]benzenesulfonamide IUPAC Name: 4-[(E)-3-(2,4-dimethoxy-5-pyrrolidin-1-ylphenyl)prop-2-enoyl]-N-(3-imidazol-1-ylpropyl)benzenesulfonamide Traditional Name: 4-[(E)-3-(2,4-dimethoxy-5-pyrrolidino-phenyl)acryloyl]-N-(3-imidazol-1-ylpropyl)benzenesulfonamide Formula: C27H32N4O5S MolecularWeight: 524.63178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C=CC(=O)C2=CC=C(C=C2)S(=O)(=O)NCCCN3C=CN=C3)N4CCCC4)OC

Isomeric SMILES

COC1=CC(=C(C=C1/C=C/C(=O)C2=CC=C(C=C2)S(=O)(=O)NCCCN3C=CN=C3)N4CCCC4)OC

InChI

InChI=1S/C27H32N4O5S/c1-35-26-19-27(36-2)24(31-15-3-4-16-31)18-22(26)8-11-25(32)21-6-9-23(10-7-21)37(33,34)29-12-5-14-30-17-13-28-20-30/h6-11,13,17-20,29H,3-5,12,14-16H2,1-2H3/b11-8+