3-butyl-3-ethyl-4-oxidanyl-5-pyridin-4-yl-2,5-dihydro-1$l^{6},4-benzothiazepine 1,1-dioxide

Systemtic Name: 3-butyl-3-ethyl-4-oxidanyl-5-pyridin-4-yl-2,5-dihydro-1$l^{6},4-benzothiazepine 1,1-dioxide Openeye Name: 3-butyl-3-ethyl-4-hydroxy-5-(4-pyridyl)-2,5-dihydro-1$l^{6},4-benzothiazepine 1,1-dioxide CAS Name: 3-butyl-3-ethyl-4-hydroxy-5-pyridin-4-yl-2,5-dihydro-1$l^{6},4-benzothiazepine 1,1-dioxide IUPAC Name: 3-butyl-3-ethyl-4-hydroxy-5-pyridin-4-yl-2,5-dihydro-1$l^{6},4-benzothiazepine 1,1-dioxide Traditional Name: 3-butyl-3-ethyl-4-hydroxy-5-(4-pyridyl)-2,5-dihydro-1$l^{6},4-benzothiazepine 1,1-dioxide Formula: C20H26N2O3S MolecularWeight: 374.49704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CS(=O)(=O)C2=CC=CC=C2C(N1O)C3=CC=NC=C3)CC

Isomeric SMILES

CCCCC1(CS(=O)(=O)C2=CC=CC=C2C(N1O)C3=CC=NC=C3)CC

InChI

InChI=1S/C20H26N2O3S/c1-3-5-12-20(4-2)15-26(24,25)18-9-7-6-8-17(18)19(22(20)23)16-10-13-21-14-11-16/h6-11,13-14,19,23H,3-5,12,15H2,1-2H3