1-methyl-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde

Systemtic Name: 1-methyl-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Openeye Name: 1-methyl-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde CAS Name: 1-methyl-4-(phenylthio)-3,4-dihydro-1H-isoquinoline-2-carboxaldehyde IUPAC Name: 1-methyl-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Traditional Name: 1-methyl-4-(phenylthio)-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Formula: C17H17NOS MolecularWeight: 283.38798

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CC=C2C(CN1C=O)SC3=CC=CC=C3

Isomeric SMILES

CC1C2=CC=CC=C2C(CN1C=O)SC3=CC=CC=C3

InChI

InChI=1S/C17H17NOS/c1-13-15-9-5-6-10-16(15)17(11-18(13)12-19)20-14-7-3-2-4-8-14/h2-10,12-13,17H,11H2,1H3