N-[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide

Systemtic Name: N-[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Openeye Name: N-[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide CAS Name: N-[(4-fluorophenyl)-(1-methyl-2-imidazolyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide IUPAC Name: N-[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-sulfonamide Traditional Name: N-[(4-fluorophenyl)-(1-methylimidazol-2-yl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-sulfonamide Formula: C20H20FN3O4S MolecularWeight: 417.453903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=CC=C(C=C2)F)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CN1C=CN=C1C(C2=CC=C(C=C2)F)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C20H20FN3O4S/c1-24-10-9-22-20(24)19(14-3-5-15(21)6-4-14)23-29(25,26)16-7-8-17-18(13-16)28-12-2-11-27-17/h3-10,13,19,23H,2,11-12H2,1H3