N-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylcarbonyl)phenyl]-3-nitro-4-oxidanyl-benzenesulfonamide

Systemtic Name: N-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylcarbonyl)phenyl]-3-nitro-4-oxidanyl-benzenesulfonamide Openeye Name: N-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)phenyl]-4-hydroxy-3-nitro-benzenesulfonamide CAS Name: N-[4-[6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl(oxo)methyl]phenyl]-4-hydroxy-3-nitrobenzenesulfonamide IUPAC Name: N-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)phenyl]-4-hydroxy-3-nitrobenzenesulfonamide Traditional Name: N-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)phenyl]-4-hydroxy-3-nitro-benzenesulfonamide Formula: C20H17N3O6S2 MolecularWeight: 459.49548

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1SC=C2)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC(=C(C=C4)O)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=C1SC=C2)C(=O)C3=CC=C(C=C3)NS(=O)(=O)C4=CC(=C(C=C4)O)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O6S2/c24-18-6-5-16(11-17(18)23(26)27)31(28,29)21-15-3-1-13(2-4-15)20(25)22-9-7-19-14(12-22)8-10-30-19/h1-6,8,10-11,21,24H,7,9,12H2