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

Systemtic Name: 4-[2-(2,4-dimethoxy-5-pyrrolidin-1-yl-phenyl)prop-2-enoyl]-N-(3-imidazol-1-ylpropyl)benzenesulfonamide Openeye Name: 4-[2-(2,4-dimethoxy-5-pyrrolidin-1-yl-phenyl)prop-2-enoyl]-N-(3-imidazol-1-ylpropyl)benzenesulfonamide CAS Name: 4-[2-[2,4-dimethoxy-5-(1-pyrrolidinyl)phenyl]-1-oxoprop-2-enyl]-N-[3-(1-imidazolyl)propyl]benzenesulfonamide IUPAC Name: 4-[2-(2,4-dimethoxy-5-pyrrolidin-1-ylphenyl)prop-2-enoyl]-N-(3-imidazol-1-ylpropyl)benzenesulfonamide Traditional Name: 4-[2-(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(=C)C(=O)C2=CC=C(C=C2)S(=O)(=O)NCCCN3C=CN=C3)N4CCCC4)OC

Isomeric SMILES

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

InChI

InChI=1S/C27H32N4O5S/c1-20(23-17-24(31-14-4-5-15-31)26(36-3)18-25(23)35-2)27(32)21-7-9-22(10-8-21)37(33,34)29-11-6-13-30-16-12-28-19-30/h7-10,12,16-19,29H,1,4-6,11,13-15H2,2-3H3