7,8-dimethoxy-6-phenylsulfanyl-2,3,4,5-tetrahydro-1H-3-benzazepine

Systemtic Name: 7,8-dimethoxy-6-phenylsulfanyl-2,3,4,5-tetrahydro-1H-3-benzazepine Openeye Name: 7,8-dimethoxy-6-phenylsulfanyl-2,3,4,5-tetrahydro-1H-3-benzazepine CAS Name: 7,8-dimethoxy-6-(phenylthio)-2,3,4,5-tetrahydro-1H-3-benzazepine IUPAC Name: 7,8-dimethoxy-6-phenylsulfanyl-2,3,4,5-tetrahydro-1H-3-benzazepine Traditional Name: 7,8-dimethoxy-6-(phenylthio)-2,3,4,5-tetrahydro-1H-3-benzazepine Formula: C18H21NO2S MolecularWeight: 315.42984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2CCNCCC2=C1)SC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C(=C2CCNCCC2=C1)SC3=CC=CC=C3)OC

InChI

InChI=1S/C18H21NO2S/c1-20-16-12-13-8-10-19-11-9-15(13)18(17(16)21-2)22-14-6-4-3-5-7-14/h3-7,12,19H,8-11H2,1-2H3