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

Systemtic Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-3-(1H-indol-3-yl)propanamide Openeye Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-3-(1H-indol-3-yl)propanamide CAS Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-3-(1H-indol-3-yl)propanamide IUPAC Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-3-(1H-indol-3-yl)propanamide Traditional Name: N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)phenyl]-3-(1H-indol-3-yl)propionamide Formula: C26H25N3O5S MolecularWeight: 491.5588

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)NC(=O)CCC4=CNC5=CC=CC=C54)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)NC(=O)CCC4=CNC5=CC=CC=C54)OC1

InChI

InChI=1S/C26H25N3O5S/c30-26(13-6-18-17-27-23-5-2-1-4-22(18)23)28-19-7-9-20(10-8-19)29-35(31,32)21-11-12-24-25(16-21)34-15-3-14-33-24/h1-2,4-5,7-12,16-17,27,29H,3,6,13-15H2,(H,28,30)