2-benzo[b][1]benzothiepin-5-ylsulfanyl-N,N-dimethyl-ethanamine hydrochloride

Systemtic Name: 2-benzo[b][1]benzothiepin-5-ylsulfanyl-N,N-dimethyl-ethanamine hydrochloride Openeye Name: 2-benzo[b][1]benzothiepin-5-ylsulfanyl-N,N-dimethyl-ethanamine hydrochloride CAS Name: 2-(5-benzo[b][1]benzothiepinylthio)-N,N-dimethylethanamine hydrochloride IUPAC Name: 2-benzo[b][1]benzothiepin-5-ylsulfanyl-N,N-dimethylethanamine hydrochloride Traditional Name: 2-(benzo[b][1]benzothiepin-5-ylthio)ethyl-dimethyl-amine hydrochloride Formula: C18H20ClNS2 MolecularWeight: 349.9411

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=CC2=CC=CC=C2SC3=CC=CC=C31.Cl

Isomeric SMILES

CN(C)CCSC1=CC2=CC=CC=C2SC3=CC=CC=C31.Cl

InChI

InChI=1S/C18H19NS2.ClH/c1-19(2)11-12-20-18-13-14-7-3-5-9-16(14)21-17-10-6-4-8-15(17)18;/h3-10,13H,11-12H2,1-2H3;1H