N-(furan-2-ylmethyl)-4-[(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonylamino)carbamoyl]benzenesulfonamide

Systemtic Name: N-(furan-2-ylmethyl)-4-[(4,5,6,7-tetrahydro-1-benzothiophen-2-ylcarbonylamino)carbamoyl]benzenesulfonamide Openeye Name: N-(2-furylmethyl)-4-[(4,5,6,7-tetrahydrobenzothiophene-2-carbonylamino)carbamoyl]benzenesulfonamide CAS Name: N-(2-furanylmethyl)-4-[oxo-[[oxo(4,5,6,7-tetrahydro-1-benzothiophen-2-yl)methyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: N-(furan-2-ylmethyl)-4-[(4,5,6,7-tetrahydro-1-benzothiophene-2-carbonylamino)carbamoyl]benzenesulfonamide Traditional Name: N-(2-furfuryl)-4-[(4,5,6,7-tetrahydrobenzothiophene-2-carbonylamino)carbamoyl]benzenesulfonamide Formula: C21H21N3O5S2 MolecularWeight: 459.53854

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CO4

Isomeric SMILES

C1CCC2=C(C1)C=C(S2)C(=O)NNC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC4=CC=CO4

InChI

InChI=1S/C21H21N3O5S2/c25-20(23-24-21(26)19-12-15-4-1-2-6-18(15)30-19)14-7-9-17(10-8-14)31(27,28)22-13-16-5-3-11-29-16/h3,5,7-12,22H,1-2,4,6,13H2,(H,23,25)(H,24,26)