N-methyl-2-(2-methylsulfanylbenzo[b][1]benzoxepin-6-yl)sulfanyl-ethanamine

Systemtic Name: N-methyl-2-(2-methylsulfanylbenzo[b][1]benzoxepin-6-yl)sulfanyl-ethanamine Openeye Name: N-methyl-2-(2-methylsulfanylbenzo[b][1]benzoxepin-6-yl)sulfanyl-ethanamine CAS Name: N-methyl-2-[[2-(methylthio)-6-benzo[b][1]benzoxepinyl]thio]ethanamine IUPAC Name: N-methyl-2-(2-methylsulfanylbenzo[b][1]benzoxepin-6-yl)sulfanylethanamine Traditional Name: methyl-[2-[[2-(methylthio)benzo[b][1]benzoxepin-6-yl]thio]ethyl]amine Formula: C18H19NOS2 MolecularWeight: 329.47956

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Descriptors Computed from Structure

Canonical SMILES:

CNCCSC1=CC2=C(C=C(C=C2)SC)OC3=CC=CC=C31

Isomeric SMILES

CNCCSC1=CC2=C(C=C(C=C2)SC)OC3=CC=CC=C31

InChI

InChI=1S/C18H19NOS2/c1-19-9-10-22-18-11-13-7-8-14(21-2)12-17(13)20-16-6-4-3-5-15(16)18/h3-8,11-12,19H,9-10H2,1-2H3