N-[3-(diethylsulfamoyl)-4-ethoxy-phenyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-[3-(diethylsulfamoyl)-4-ethoxy-phenyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[3-(diethylsulfamoyl)-4-ethoxy-phenyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[3-(diethylsulfamoyl)-4-ethoxyphenyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-[3-(diethylsulfamoyl)-4-ethoxyphenyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-[3-(diethylsulfamoyl)-4-ethoxy-phenyl]-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C22H27N3O5S2 MolecularWeight: 477.59688

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)OCC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)OCC

InChI

InChI=1S/C22H27N3O5S2/c1-4-25(5-2)32(28,29)20-14-16(8-9-18(20)30-6-3)23-22(27)15-7-10-19-17(13-15)24-21(26)11-12-31-19/h7-10,13-14H,4-6,11-12H2,1-3H3,(H,23,27)(H,24,26)