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

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

CC1C(C2=CC=CC=C2CN1C=O)SC3=CC=CC=C3

Isomeric SMILES

C[C@H]1C(C2=CC=CC=C2CN1C=O)SC3=CC=CC=C3

InChI

InChI=1S/C17H17NOS/c1-13-17(20-15-8-3-2-4-9-15)16-10-6-5-7-14(16)11-18(13)12-19/h2-10,12-13,17H,11H2,1H3/t13-,17?/m0/s1