3-(3-chloranyl-6H-benzo[b][1,4]benzothiazepin-5-yl)-N,N-dimethyl-propan-1-amine hydrobromide

Systemtic Name: 3-(3-chloranyl-6H-benzo[b][1,4]benzothiazepin-5-yl)-N,N-dimethyl-propan-1-amine hydrobromide Openeye Name: 3-(3-chloro-6H-benzo[b][1,4]benzothiazepin-5-yl)-N,N-dimethyl-propan-1-amine hydrobromide CAS Name: 3-(3-chloro-6H-benzo[b][1,4]benzothiazepin-5-yl)-N,N-dimethyl-1-propanamine hydrobromide IUPAC Name: 3-(3-chloro-6H-benzo[b][1,4]benzothiazepin-5-yl)-N,N-dimethylpropan-1-amine hydrobromide Traditional Name: 3-(3-chloro-6H-benzo[b][1,4]benzothiazepin-5-yl)propyl-dimethyl-amine hydrobromide Formula: C18H22BrClN2S MolecularWeight: 413.80268

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1CC2=CC=CC=C2SC3=C1C=C(C=C3)Cl.Br

Isomeric SMILES

CN(C)CCCN1CC2=CC=CC=C2SC3=C1C=C(C=C3)Cl.Br

InChI

InChI=1S/C18H21ClN2S.BrH/c1-20(2)10-5-11-21-13-14-6-3-4-7-17(14)22-18-9-8-15(19)12-16(18)21;/h3-4,6-9,12H,5,10-11,13H2,1-2H3;1H