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

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[(5-sulfamoylthiophen-2-yl)methyl]propanamide Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[(5-sulfamoyl-2-thienyl)methyl]propanamide CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[(5-sulfamoyl-2-thiophenyl)methyl]propanamide IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[(5-sulfamoylthiophen-2-yl)methyl]propanamide Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-[(5-sulfamoyl-2-thienyl)methyl]propionamide Formula: C17H21N3O7S3 MolecularWeight: 475.55954

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCC(=O)NCC3=CC=C(S3)S(=O)(=O)N)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NCCC(=O)NCC3=CC=C(S3)S(=O)(=O)N)OC1

InChI

InChI=1S/C17H21N3O7S3/c18-29(22,23)17-5-2-12(28-17)11-19-16(21)6-7-20-30(24,25)13-3-4-14-15(10-13)27-9-1-8-26-14/h2-5,10,20H,1,6-9,11H2,(H,19,21)(H2,18,22,23)