3-butyl-3-ethyl-2-(2-methylpropyl)-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide

Systemtic Name: 3-butyl-3-ethyl-2-(2-methylpropyl)-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide Openeye Name: 3-butyl-3-ethyl-2-isobutyl-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide CAS Name: 3-butyl-3-ethyl-2-(2-methylpropyl)-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide IUPAC Name: 3-butyl-3-ethyl-2-(2-methylpropyl)-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide Traditional Name: 3-butyl-3-ethyl-2-isobutyl-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide Formula: C25H35NO2S MolecularWeight: 413.6159

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CN(C2=CC=CC=C2S(=O)(=O)C1CC(C)C)C3=CC=CC=C3)CC

Isomeric SMILES

CCCCC1(CN(C2=CC=CC=C2S(=O)(=O)C1CC(C)C)C3=CC=CC=C3)CC

InChI

InChI=1S/C25H35NO2S/c1-5-7-17-25(6-2)19-26(21-13-9-8-10-14-21)22-15-11-12-16-23(22)29(27,28)24(25)18-20(3)4/h8-16,20,24H,5-7,17-19H2,1-4H3