2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-[(5-sulfamoylthiophen-2-yl)methyl]ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCC1=CC=C(S1)S(=O)(=O)N)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CN(CC(=O)NCC1=CC=C(S1)S(=O)(=O)N)S(=O)(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C17H21N3O7S3/c1-20(11-16(21)19-10-12-3-6-17(28-12)29(18,22)23)30(24,25)13-4-5-14-15(9-13)27-8-2-7-26-14/h3-6,9H,2,7-8,10-11H2,1H3,(H,19,21)(H2,18,22,23)