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

Systemtic Name: 3-butyl-3-ethyl-7-methoxy-5-phenyl-4,5-dihydro-2H-1$l^{6},4-benzothiazepine 1,1-dioxide hydrochloride Openeye Name: 3-butyl-3-ethyl-7-methoxy-5-phenyl-4,5-dihydro-2H-1$l^{6},4-benzothiazepine 1,1-dioxide hydrochloride CAS Name: 3-butyl-3-ethyl-7-methoxy-5-phenyl-4,5-dihydro-2H-1$l^{6},4-benzothiazepine 1,1-dioxide hydrochloride IUPAC Name: 3-butyl-3-ethyl-7-methoxy-5-phenyl-4,5-dihydro-2H-1$l^{6},4-benzothiazepine 1,1-dioxide hydrochloride Traditional Name: 3-butyl-3-ethyl-7-methoxy-5-phenyl-4,5-dihydro-2H-1$l^{6},4-benzothiazepine 1,1-dioxide hydrochloride Formula: C22H30ClNO3S MolecularWeight: 423.9965

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CS(=O)(=O)C2=C(C=C(C=C2)OC)C(N1)C3=CC=CC=C3)CC.Cl

Isomeric SMILES

CCCCC1(CS(=O)(=O)C2=C(C=C(C=C2)OC)C(N1)C3=CC=CC=C3)CC.Cl

InChI

InChI=1S/C22H29NO3S.ClH/c1-4-6-14-22(5-2)16-27(24,25)20-13-12-18(26-3)15-19(20)21(23-22)17-10-8-7-9-11-17;/h7-13,15,21,23H,4-6,14,16H2,1-3H3;1H