2-(5,6-dihydrobenzo[b][1]benzothiepin-5-ylsulfanyl)-N-methyl-ethanamine hydrochloride

Systemtic Name: 2-(5,6-dihydrobenzo[b][1]benzothiepin-5-ylsulfanyl)-N-methyl-ethanamine hydrochloride Openeye Name: 2-(5,6-dihydrobenzo[b][1]benzothiepin-5-ylsulfanyl)-N-methyl-ethanamine hydrochloride CAS Name: 2-(5,6-dihydrobenzo[b][1]benzothiepin-5-ylthio)-N-methylethanamine hydrochloride IUPAC Name: 2-(5,6-dihydrobenzo[b][1]benzothiepin-5-ylsulfanyl)-N-methylethanamine hydrochloride Traditional Name: 2-(5,6-dihydrobenzo[b][1]benzothiepin-5-ylthio)ethyl-methyl-amine hydrochloride Formula: C17H20ClNS2 MolecularWeight: 337.9304

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Descriptors Computed from Structure

Canonical SMILES:

CNCCSC1CC2=CC=CC=C2SC3=CC=CC=C13.Cl

Isomeric SMILES

CNCCSC1CC2=CC=CC=C2SC3=CC=CC=C13.Cl

InChI

InChI=1S/C17H19NS2.ClH/c1-18-10-11-19-17-12-13-6-2-4-8-15(13)20-16-9-5-3-7-14(16)17;/h2-9,17-18H,10-12H2,1H3;1H