4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(3-fluoranyl-4-methyl-phenyl)benzamide

Systemtic Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(3-fluoranyl-4-methyl-phenyl)benzamide Openeye Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(3-fluoro-4-methyl-phenyl)benzamide CAS Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(3-fluoro-4-methylphenyl)benzamide IUPAC Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(3-fluoro-4-methylphenyl)benzamide Traditional Name: 4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(3-fluoro-4-methyl-phenyl)benzamide Formula: C23H21FN2O5S MolecularWeight: 456.486643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4)F

InChI

InChI=1S/C23H21FN2O5S/c1-15-3-6-18(13-20(15)24)25-23(27)16-4-7-17(8-5-16)26-32(28,29)19-9-10-21-22(14-19)31-12-2-11-30-21/h3-10,13-14,26H,2,11-12H2,1H3,(H,25,27)