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

Systemtic Name: 3-[[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]carbonylamino]methyl]-N-methyl-benzamide Openeye Name: 3-[[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzoyl]amino]methyl]-N-methyl-benzamide CAS Name: 3-[[[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-oxomethyl]amino]methyl]-N-methylbenzamide IUPAC Name: 3-[[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzoyl]amino]methyl]-N-methylbenzamide Traditional Name: 3-[[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzoyl]amino]methyl]-N-methyl-benzamide Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)CNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)CNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C25H25N3O6S/c1-26-24(29)19-5-2-4-17(14-19)16-27-25(30)18-6-8-20(9-7-18)28-35(31,32)21-10-11-22-23(15-21)34-13-3-12-33-22/h2,4-11,14-15,28H,3,12-13,16H2,1H3,(H,26,29)(H,27,30)