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

Systemtic Name: N-[4-[(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)carbonyl]-3-oxidanyl-phenyl]-3-nitro-benzenesulfonamide Openeye Name: N-[4-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)-3-hydroxy-phenyl]-3-nitro-benzenesulfonamide CAS Name: N-[4-[(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-oxomethyl]-3-hydroxyphenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[4-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)-3-hydroxyphenyl]-3-nitrobenzenesulfonamide Traditional Name: N-[4-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)-3-hydroxy-phenyl]-3-nitro-benzenesulfonamide Formula: C22H21N3O6S2 MolecularWeight: 487.54864

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C2=C(CCN1C(=O)C3=C(C=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-])O)SC=C2

Isomeric SMILES

CCC1C2=C(CCN1C(=O)C3=C(C=C(C=C3)NS(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-])O)SC=C2

InChI

InChI=1S/C22H21N3O6S2/c1-2-19-17-9-11-32-21(17)8-10-24(19)22(27)18-7-6-14(12-20(18)26)23-33(30,31)16-5-3-4-15(13-16)25(28)29/h3-7,9,11-13,19,23,26H,2,8,10H2,1H3