N-[3-[(4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-7-yl)sulfonylamino]phenyl]ethanamide

Systemtic Name: N-[3-[(4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-7-yl)sulfonylamino]phenyl]ethanamide Openeye Name: N-[3-[(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-7-yl)sulfonylamino]phenyl]acetamide CAS Name: N-[3-[(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-7-yl)sulfonylamino]phenyl]acetamide IUPAC Name: N-[3-[(4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-7-yl)sulfonylamino]phenyl]acetamide Traditional Name: N-[3-[(4-keto-3,5-dihydro-2H-1,5-benzothiazepin-7-yl)sulfonylamino]phenyl]acetamide Formula: C17H17N3O4S2 MolecularWeight: 391.46458

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NS(=O)(=O)C2=CC3=C(C=C2)SCCC(=O)N3

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NS(=O)(=O)C2=CC3=C(C=C2)SCCC(=O)N3

InChI

InChI=1S/C17H17N3O4S2/c1-11(21)18-12-3-2-4-13(9-12)20-26(23,24)14-5-6-16-15(10-14)19-17(22)7-8-25-16/h2-6,9-10,20H,7-8H2,1H3,(H,18,21)(H,19,22)