N-[4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethoxy]phenyl]-N,4-dimethyl-benzenesulfonamide

Systemtic Name: N-[4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxidanylidene-ethoxy]phenyl]-N,4-dimethyl-benzenesulfonamide Openeye Name: N-[4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxo-ethoxy]phenyl]-N,4-dimethyl-benzenesulfonamide CAS Name: N-[4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethoxy]phenyl]-N,4-dimethylbenzenesulfonamide IUPAC Name: N-[4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-oxoethoxy]phenyl]-N,4-dimethylbenzenesulfonamide Traditional Name: N-[4-[2-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-keto-ethoxy]phenyl]-N,4-dimethyl-benzenesulfonamide Formula: C25H26N2O4S2 MolecularWeight: 482.61494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)N3CCCSC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)OCC(=O)N3CCCSC4=CC=CC=C43

InChI

InChI=1S/C25H26N2O4S2/c1-19-8-14-22(15-9-19)33(29,30)26(2)20-10-12-21(13-11-20)31-18-25(28)27-16-5-17-32-24-7-4-3-6-23(24)27/h3-4,6-15H,5,16-18H2,1-2H3