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

Systemtic Name: 1-cyclohexyl-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Openeye Name: 1-cyclohexyl-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde CAS Name: 1-cyclohexyl-4-(phenylthio)-3,4-dihydro-1H-isoquinoline-2-carboxaldehyde IUPAC Name: 1-cyclohexyl-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Traditional Name: 1-cyclohexyl-4-(phenylthio)-3,4-dihydro-1H-isoquinoline-2-carbaldehyde Formula: C22H25NOS MolecularWeight: 351.505

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2C3=CC=CC=C3C(CN2C=O)SC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)C2C3=CC=CC=C3C(CN2C=O)SC4=CC=CC=C4

InChI

InChI=1S/C22H25NOS/c24-16-23-15-21(25-18-11-5-2-6-12-18)19-13-7-8-14-20(19)22(23)17-9-3-1-4-10-17/h2,5-8,11-14,16-17,21-22H,1,3-4,9-10,15H2