N-methyl-2-(2-methylsulfanylbenzo[b][1]benzothiepin-5-yl)sulfanyl-ethanamine

Systemtic Name: N-methyl-2-(2-methylsulfanylbenzo[b][1]benzothiepin-5-yl)sulfanyl-ethanamine Openeye Name: N-methyl-2-(2-methylsulfanylbenzo[b][1]benzothiepin-5-yl)sulfanyl-ethanamine CAS Name: N-methyl-2-[[2-(methylthio)-5-benzo[b][1]benzothiepinyl]thio]ethanamine IUPAC Name: N-methyl-2-(2-methylsulfanylbenzo[b][1]benzothiepin-5-yl)sulfanylethanamine Traditional Name: methyl-[2-[[2-(methylthio)benzo[b][1]benzothiepin-5-yl]thio]ethyl]amine Formula: C18H19NS3 MolecularWeight: 345.54516

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Descriptors Computed from Structure

Canonical SMILES:

CNCCSC1=CC2=CC=CC=C2SC3=C1C=CC(=C3)SC

Isomeric SMILES

CNCCSC1=CC2=CC=CC=C2SC3=C1C=CC(=C3)SC

InChI

InChI=1S/C18H19NS3/c1-19-9-10-21-17-11-13-5-3-4-6-16(13)22-18-12-14(20-2)7-8-15(17)18/h3-8,11-12,19H,9-10H2,1-2H3