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

Systemtic Name: 6,8-dimethoxy-5-phenylsulfanyl-1,3,4,5-tetrahydro-2-benzazepine-2-carbaldehyde Openeye Name: 6,8-dimethoxy-5-phenylsulfanyl-1,3,4,5-tetrahydro-2-benzazepine-2-carbaldehyde CAS Name: 6,8-dimethoxy-5-(phenylthio)-1,3,4,5-tetrahydro-2-benzazepine-2-carboxaldehyde IUPAC Name: 6,8-dimethoxy-5-phenylsulfanyl-1,3,4,5-tetrahydro-2-benzazepine-2-carbaldehyde Traditional Name: 6,8-dimethoxy-5-(phenylthio)-1,3,4,5-tetrahydro-2-benzazepine-2-carbaldehyde Formula: C19H21NO3S MolecularWeight: 343.43994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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