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

Systemtic Name: N,N-diethyl-3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-ylcarbonylamino)carbamoyl]benzenesulfonamide Openeye Name: N,N-diethyl-3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)carbamoyl]benzenesulfonamide CAS Name: N,N-diethyl-3-[oxo-[[oxo(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)methyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: N,N-diethyl-3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)carbamoyl]benzenesulfonamide Traditional Name: N,N-diethyl-3-[(5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carbonylamino)carbamoyl]benzenesulfonamide Formula: C21H27N3O4S2 MolecularWeight: 449.58678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O4S2/c1-3-24(4-2)30(27,28)17-11-8-10-16(13-17)20(25)22-23-21(26)19-14-15-9-6-5-7-12-18(15)29-19/h8,10-11,13-14H,3-7,9,12H2,1-2H3,(H,22,25)(H,23,26)