4-oxidanylidene-N-(3-sulfamoylphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: 4-oxidanylidene-N-(3-sulfamoylphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: 4-oxo-N-(3-sulfamoylphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: 4-oxo-N-(3-sulfamoylphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: 4-oxo-N-(3-sulfamoylphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: 4-keto-N-(3-sulfamoylphenyl)-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C16H15N3O4S2 MolecularWeight: 377.438

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N)NC1=O

Isomeric SMILES

C1CSC2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N)NC1=O

InChI

InChI=1S/C16H15N3O4S2/c17-25(22,23)12-3-1-2-11(9-12)18-16(21)10-4-5-14-13(8-10)19-15(20)6-7-24-14/h1-5,8-9H,6-7H2,(H,18,21)(H,19,20)(H2,17,22,23)