7,8-dimethoxy-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde

Systemtic Name: 7,8-dimethoxy-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Openeye Name: 7,8-dimethoxy-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde CAS Name: 7,8-dimethoxy-4-(phenylthio)-3,4-dihydro-1H-isoquinoline-2-carboxaldehyde IUPAC Name: 7,8-dimethoxy-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Traditional Name: 7,8-dimethoxy-4-(phenylthio)-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(CN(C2)C=O)SC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(CN(C2)C=O)SC3=CC=CC=C3)OC

InChI

InChI=1S/C18H19NO3S/c1-21-16-9-8-14-15(18(16)22-2)10-19(12-20)11-17(14)23-13-6-4-3-5-7-13/h3-9,12,17H,10-11H2,1-2H3