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

Systemtic Name: (3S)-3-butyl-7-chloranyl-3-ethyl-8-methoxy-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide Openeye Name: (3S)-3-butyl-7-chloro-3-ethyl-8-methoxy-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide CAS Name: (3S)-3-butyl-7-chloro-3-ethyl-8-methoxy-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide IUPAC Name: (3S)-3-butyl-7-chloro-3-ethyl-8-methoxy-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide Traditional Name: (3S)-3-butyl-7-chloro-3-ethyl-8-methoxy-5-phenyl-2,4-dihydro-1$l^{6},5-benzothiazepine 1,1-dioxide Formula: C22H28ClNO3S MolecularWeight: 421.98062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCC[C@]1(CN(C2=CC(=C(C=C2S(=O)(=O)C1)OC)Cl)C3=CC=CC=C3)CC

InChI

InChI=1S/C22H28ClNO3S/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/t22-/m0/s1