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

Systemtic Name: 7,8-dimethoxy-5-phenylsulfanyl-1,3,4,5-tetrahydro-2-benzazepine-2-carbaldehyde Openeye Name: 7,8-dimethoxy-5-phenylsulfanyl-1,3,4,5-tetrahydro-2-benzazepine-2-carbaldehyde CAS Name: 7,8-dimethoxy-5-(phenylthio)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxaldehyde IUPAC Name: 7,8-dimethoxy-5-phenylsulfanyl-1,3,4,5-tetrahydro-2-benzazepine-2-carbaldehyde Traditional Name: 7,8-dimethoxy-5-(phenylthio)-1,3,4,5-tetrahydro-2-benzazepine-2-carbaldehyde Formula: C19H21NO3S MolecularWeight: 343.43994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(CCN(CC2=C1)C=O)SC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C2C(CCN(CC2=C1)C=O)SC3=CC=CC=C3)OC

InChI

InChI=1S/C19H21NO3S/c1-22-17-10-14-12-20(13-21)9-8-19(16(14)11-18(17)23-2)24-15-6-4-3-5-7-15/h3-7,10-11,13,19H,8-9,12H2,1-2H3