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

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(1H-indol-3-yl)ethyl]propanamide Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(1H-indol-3-yl)ethyl]propanamide CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(1H-indol-3-yl)ethyl]propanamide IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(1H-indol-3-yl)ethyl]propanamide Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[2-(1H-indol-3-yl)ethyl]propionamide Formula: C22H25N3O5S MolecularWeight: 443.516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCC(=O)NCCC3=CNC4=CC=CC=C43)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCC(=O)NCCC3=CNC4=CC=CC=C43)OC1

InChI

InChI=1S/C22H25N3O5S/c26-22(23-10-8-16-15-24-19-5-2-1-4-18(16)19)9-11-25-31(27,28)17-6-7-20-21(14-17)30-13-3-12-29-20/h1-2,4-7,14-15,24-25H,3,8-13H2,(H,23,26)