N-(2-benzo[b][1]benzoxepin-5-ylsulfanylethyl)-2-phenyl-ethanamine

Systemtic Name: N-(2-benzo[b][1]benzoxepin-5-ylsulfanylethyl)-2-phenyl-ethanamine Openeye Name: N-(2-benzo[b][1]benzoxepin-5-ylsulfanylethyl)-2-phenyl-ethanamine CAS Name: N-[2-(5-benzo[b][1]benzoxepinylthio)ethyl]-2-phenylethanamine IUPAC Name: N-(2-benzo[b][1]benzoxepin-5-ylsulfanylethyl)-2-phenylethanamine Traditional Name: 2-(benzo[b][1]benzoxepin-5-ylthio)ethyl-phenethyl-amine Formula: C24H23NOS MolecularWeight: 373.51052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNCCSC2=CC3=CC=CC=C3OC4=CC=CC=C42

Isomeric SMILES

C1=CC=C(C=C1)CCNCCSC2=CC3=CC=CC=C3OC4=CC=CC=C42

InChI

InChI=1S/C24H23NOS/c1-2-8-19(9-3-1)14-15-25-16-17-27-24-18-20-10-4-6-12-22(20)26-23-13-7-5-11-21(23)24/h1-13,18,25H,14-17H2