3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)sulfamoyl]benzenesulfonamide

Systemtic Name: 3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)sulfamoyl]benzenesulfonamide Openeye Name: 3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)sulfamoyl]benzenesulfonamide CAS Name: 3-[[[oxo(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)methyl]amino]sulfamoyl]benzenesulfonamide IUPAC Name: 3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)sulfamoyl]benzenesulfonamide Traditional Name: 3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)sulfamoyl]benzenesulfonamide Formula: C16H19N3O5S3 MolecularWeight: 429.53416

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2)C(=O)NNS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2)C(=O)NNS(=O)(=O)C3=CC=CC(=C3)S(=O)(=O)N

InChI

InChI=1S/C16H19N3O5S3/c17-26(21,22)12-6-4-7-13(10-12)27(23,24)19-18-16(20)15-9-11-5-2-1-3-8-14(11)25-15/h4,6-7,9-10,19H,1-3,5,8H2,(H,18,20)(H2,17,21,22)