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

Systemtic Name: methyl 3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)sulfamoyl]benzoate Openeye Name: methyl 3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)sulfamoyl]benzoate CAS Name: 3-[[[oxo(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)methyl]amino]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)sulfamoyl]benzoate Traditional Name: 3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)sulfamoyl]benzoic acid methyl ester Formula: C18H20N2O5S2 MolecularWeight: 408.4918

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)S(=O)(=O)NNC(=O)C2=CC3=C(S2)CCCCC3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)S(=O)(=O)NNC(=O)C2=CC3=C(S2)CCCCC3

InChI

InChI=1S/C18H20N2O5S2/c1-25-18(22)13-7-5-8-14(10-13)27(23,24)20-19-17(21)16-11-12-6-3-2-4-9-15(12)26-16/h5,7-8,10-11,20H,2-4,6,9H2,1H3,(H,19,21)