N-[2-(5,6-dihydrobenzo[b][1]benzoxepin-5-ylsulfanyl)ethyl]-2-phenyl-ethanamine

Systemtic Name: N-[2-(5,6-dihydrobenzo[b][1]benzoxepin-5-ylsulfanyl)ethyl]-2-phenyl-ethanamine Openeye Name: N-[2-(5,6-dihydrobenzo[b][1]benzoxepin-5-ylsulfanyl)ethyl]-2-phenyl-ethanamine CAS Name: N-[2-(5,6-dihydrobenzo[b][1]benzoxepin-5-ylthio)ethyl]-2-phenylethanamine IUPAC Name: N-[2-(5,6-dihydrobenzo[b][1]benzoxepin-5-ylsulfanyl)ethyl]-2-phenylethanamine Traditional Name: 2-(5,6-dihydrobenzo[b][1]benzoxepin-5-ylthio)ethyl-phenethyl-amine Formula: C24H25NOS MolecularWeight: 375.5264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=CC=CC=C2OC3=CC=CC=C31)SCCNCCC4=CC=CC=C4

Isomeric SMILES

C1C(C2=CC=CC=C2OC3=CC=CC=C31)SCCNCCC4=CC=CC=C4

InChI

InChI=1S/C24H25NOS/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/h1-13,24-25H,14-18H2