4-[4-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonyl)piperazin-1-yl]sulfonylbenzenesulfonamide

Systemtic Name: 4-[4-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonyl)piperazin-1-yl]sulfonylbenzenesulfonamide Openeye Name: 4-[4-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonyl)piperazin-1-yl]sulfonylbenzenesulfonamide CAS Name: 4-[[4-[oxo(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)methyl]-1-piperazinyl]sulfonyl]benzenesulfonamide IUPAC Name: 4-[4-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonyl)piperazin-1-yl]sulfonylbenzenesulfonamide Traditional Name: 4-[4-(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonyl)piperazino]sulfonylbenzenesulfonamide Formula: C20H25N3O5S3 MolecularWeight: 483.6246

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(CC1)SC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CCC2=C(CC1)SC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C20H25N3O5S3/c21-30(25,26)16-6-8-17(9-7-16)31(27,28)23-12-10-22(11-13-23)20(24)19-14-15-4-2-1-3-5-18(15)29-19/h6-9,14H,1-5,10-13H2,(H2,21,25,26)