N-tert-butyl-2-[4-[(4-ethyl-5-prop-2-enoyl-2-propyl-imidazol-1-yl)methyl]-3-fluoranyl-phenyl]benzenesulfonamide

Systemtic Name: N-tert-butyl-2-[4-[(4-ethyl-5-prop-2-enoyl-2-propyl-imidazol-1-yl)methyl]-3-fluoranyl-phenyl]benzenesulfonamide Openeye Name: N-tert-butyl-2-[4-[(4-ethyl-5-prop-2-enoyl-2-propyl-imidazol-1-yl)methyl]-3-fluoro-phenyl]benzenesulfonamide CAS Name: N-tert-butyl-2-[4-[[4-ethyl-5-(1-oxoprop-2-enyl)-2-propyl-1-imidazolyl]methyl]-3-fluorophenyl]benzenesulfonamide IUPAC Name: N-tert-butyl-2-[4-[(4-ethyl-5-prop-2-enoyl-2-propylimidazol-1-yl)methyl]-3-fluorophenyl]benzenesulfonamide Traditional Name: 2-[4-[(5-acryloyl-4-ethyl-2-propyl-imidazol-1-yl)methyl]-3-fluoro-phenyl]-N-tert-butyl-benzenesulfonamide Formula: C28H34FN3O3S MolecularWeight: 511.651263

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1CC2=C(C=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(C)(C)C)F)C(=O)C=C)CC

Isomeric SMILES

CCCC1=NC(=C(N1CC2=C(C=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(C)(C)C)F)C(=O)C=C)CC

InChI

InChI=1S/C28H34FN3O3S/c1-7-12-26-30-23(8-2)27(24(33)9-3)32(26)18-20-16-15-19(17-22(20)29)21-13-10-11-14-25(21)36(34,35)31-28(4,5)6/h9-11,13-17,31H,3,7-8,12,18H2,1-2,4-6H3