2-methyl-N-[4-(4-methylpiperidin-1-yl)phenyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide

Systemtic Name: 2-methyl-N-[4-(4-methylpiperidin-1-yl)phenyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: 2-methyl-N-[4-(4-methyl-1-piperidyl)phenyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: 2-methyl-N-[4-(4-methyl-1-piperidinyl)phenyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: 2-methyl-N-[4-(4-methylpiperidin-1-yl)phenyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: 4-keto-2-methyl-N-[4-(4-methylpiperidino)phenyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C22H27N3O3S2 MolecularWeight: 445.59808

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)SC(CC(=O)N4)C

Isomeric SMILES

CC1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)SC(CC(=O)N4)C

InChI

InChI=1S/C22H27N3O3S2/c1-15-9-11-25(12-10-15)18-5-3-17(4-6-18)24-30(27,28)19-7-8-21-20(14-19)23-22(26)13-16(2)29-21/h3-8,14-16,24H,9-13H2,1-2H3,(H,23,26)