7,8-dimethoxy-5-[4-(trifluoromethylsulfanyl)phenyl]-2,3,4,5-tetrahydro-1H-3-benzazepine

Systemtic Name: 7,8-dimethoxy-5-[4-(trifluoromethylsulfanyl)phenyl]-2,3,4,5-tetrahydro-1H-3-benzazepine Openeye Name: 7,8-dimethoxy-5-[4-(trifluoromethylsulfanyl)phenyl]-2,3,4,5-tetrahydro-1H-3-benzazepine CAS Name: 7,8-dimethoxy-5-[4-(trifluoromethylthio)phenyl]-2,3,4,5-tetrahydro-1H-3-benzazepine IUPAC Name: 7,8-dimethoxy-5-[4-(trifluoromethylsulfanyl)phenyl]-2,3,4,5-tetrahydro-1H-3-benzazepine Traditional Name: 7,8-dimethoxy-5-[4-(trifluoromethylthio)phenyl]-2,3,4,5-tetrahydro-1H-3-benzazepine Formula: C19H20F3NO2S MolecularWeight: 383.42781

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(CNCCC2=C1)C3=CC=C(C=C3)SC(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C2C(CNCCC2=C1)C3=CC=C(C=C3)SC(F)(F)F)OC

InChI

InChI=1S/C19H20F3NO2S/c1-24-17-9-13-7-8-23-11-16(15(13)10-18(17)25-2)12-3-5-14(6-4-12)26-19(20,21)22/h3-6,9-10,16,23H,7-8,11H2,1-2H3