5-methoxy-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde

Systemtic Name: 5-methoxy-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Openeye Name: 5-methoxy-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde CAS Name: 5-methoxy-4-(phenylthio)-3,4-dihydro-1H-isoquinoline-2-carboxaldehyde IUPAC Name: 5-methoxy-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Traditional Name: 5-methoxy-4-(phenylthio)-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Formula: C17H17NO2S MolecularWeight: 299.38738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C(CN(C2)C=O)SC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC2=C1C(CN(C2)C=O)SC3=CC=CC=C3

InChI

InChI=1S/C17H17NO2S/c1-20-15-9-5-6-13-10-18(12-19)11-16(17(13)15)21-14-7-3-2-4-8-14/h2-9,12,16H,10-11H2,1H3