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

Systemtic Name: 2-methyl-4-oxidanylidene-N-[3-(4-phenylpiperazin-1-yl)propyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Openeye Name: 2-methyl-4-oxo-N-[3-(4-phenylpiperazin-1-yl)propyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide CAS Name: 2-methyl-4-oxo-N-[3-(4-phenyl-1-piperazinyl)propyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide IUPAC Name: 2-methyl-4-oxo-N-[3-(4-phenylpiperazin-1-yl)propyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Traditional Name: 4-keto-2-methyl-N-[3-(4-phenylpiperazino)propyl]-3,5-dihydro-2H-1,5-benzothiazepine-7-sulfonamide Formula: C23H30N4O3S2 MolecularWeight: 474.6393

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NC2=C(S1)C=CC(=C2)S(=O)(=O)NCCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1CC(=O)NC2=C(S1)C=CC(=C2)S(=O)(=O)NCCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H30N4O3S2/c1-18-16-23(28)25-21-17-20(8-9-22(21)31-18)32(29,30)24-10-5-11-26-12-14-27(15-13-26)19-6-3-2-4-7-19/h2-4,6-9,17-18,24H,5,10-16H2,1H3,(H,25,28)