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

Systemtic Name: 4-[2-(2,4-dimethoxy-5-thiophen-2-yl-phenyl)prop-2-enoyl]-N-(3-imidazol-1-ylpropyl)benzenesulfonamide Openeye Name: 4-[2-[2,4-dimethoxy-5-(2-thienyl)phenyl]prop-2-enoyl]-N-(3-imidazol-1-ylpropyl)benzenesulfonamide CAS Name: 4-[2-(2,4-dimethoxy-5-thiophen-2-ylphenyl)-1-oxoprop-2-enyl]-N-[3-(1-imidazolyl)propyl]benzenesulfonamide IUPAC Name: 4-[2-(2,4-dimethoxy-5-thiophen-2-ylphenyl)prop-2-enoyl]-N-(3-imidazol-1-ylpropyl)benzenesulfonamide Traditional Name: 4-[2-[2,4-dimethoxy-5-(2-thienyl)phenyl]acryloyl]-N-(3-imidazol-1-ylpropyl)benzenesulfonamide Formula: C27H27N3O5S2 MolecularWeight: 537.65038

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=CC=CS2)C(=C)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCCCN4C=CN=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1C2=CC=CS2)C(=C)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCCCN4C=CN=C4)OC

InChI

InChI=1S/C27H27N3O5S2/c1-19(22-16-23(26-6-4-15-36-26)25(35-3)17-24(22)34-2)27(31)20-7-9-21(10-8-20)37(32,33)29-11-5-13-30-14-12-28-18-30/h4,6-10,12,14-18,29H,1,5,11,13H2,2-3H3