N-(4-cyanophenyl)-2-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]amino]propanamide

Systemtic Name: N-(4-cyanophenyl)-2-[[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]amino]propanamide Openeye Name: N-(4-cyanophenyl)-2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)anilino]propanamide CAS Name: N-(4-cyanophenyl)-2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)anilino]propanamide IUPAC Name: N-(4-cyanophenyl)-2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)anilino]propanamide Traditional Name: N-(4-cyanophenyl)-2-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)anilino]propionamide Formula: C25H24N4O5S MolecularWeight: 492.54686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C#N)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C#N)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C25H24N4O5S/c1-17(25(30)28-20-5-3-18(16-26)4-6-20)27-19-7-9-21(10-8-19)29-35(31,32)22-11-12-23-24(15-22)34-14-2-13-33-23/h3-12,15,17,27,29H,2,13-14H2,1H3,(H,28,30)