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

Systemtic Name: 3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)sulfamoyl]benzoic acid Openeye Name: 3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)sulfamoyl]benzoic acid CAS Name: 3-[[[oxo(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)methyl]amino]sulfamoyl]benzoic acid IUPAC Name: 3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)sulfamoyl]benzoic acid Traditional Name: 3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)sulfamoyl]benzoic acid Formula: C17H18N2O5S2 MolecularWeight: 394.46522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O5S2/c20-16(15-10-11-5-2-1-3-8-14(11)25-15)18-19-26(23,24)13-7-4-6-12(9-13)17(21)22/h4,6-7,9-10,19H,1-3,5,8H2,(H,18,20)(H,21,22)