7-bromanyl-3-butyl-3-ethyl-8-methoxy-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide

Systemtic Name: 7-bromanyl-3-butyl-3-ethyl-8-methoxy-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide Openeye Name: 7-bromo-3-butyl-3-ethyl-8-methoxy-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide CAS Name: 7-bromo-3-butyl-3-ethyl-8-methoxy-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide IUPAC Name: 7-bromo-3-butyl-3-ethyl-8-methoxy-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide Traditional Name: 7-bromo-3-butyl-3-ethyl-8-methoxy-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide Formula: C22H28BrNO3S MolecularWeight: 466.43162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CN(C2=CC(=C(C=C2S(=O)(=O)C1)OC)Br)C3=CC=CC=C3)CC

Isomeric SMILES

CCCCC1(CN(C2=CC(=C(C=C2S(=O)(=O)C1)OC)Br)C3=CC=CC=C3)CC

InChI

InChI=1S/C22H28BrNO3S/c1-4-6-12-22(5-2)15-24(17-10-8-7-9-11-17)19-13-18(23)20(27-3)14-21(19)28(25,26)16-22/h7-11,13-14H,4-6,12,15-16H2,1-3H3