1,6-dimethyl-2-(4-methylphenyl)sulfonyl-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline

Systemtic Name: 1,6-dimethyl-2-(4-methylphenyl)sulfonyl-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline Openeye Name: 1,6-dimethyl-4-phenylsulfanyl-2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinoline CAS Name: 1,6-dimethyl-2-(4-methylphenyl)sulfonyl-4-(phenylthio)-3,4-dihydro-1H-isoquinoline IUPAC Name: 1,6-dimethyl-2-(4-methylphenyl)sulfonyl-4-phenylsulfanyl-3,4-dihydro-1H-isoquinoline Traditional Name: 1,6-dimethyl-4-(phenylthio)-2-tosyl-3,4-dihydro-1H-isoquinoline Formula: C24H25NO2S2 MolecularWeight: 423.5908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C=C(C=C2)C)C(CN1S(=O)(=O)C3=CC=C(C=C3)C)SC4=CC=CC=C4

Isomeric SMILES

CC1C2=C(C=C(C=C2)C)C(CN1S(=O)(=O)C3=CC=C(C=C3)C)SC4=CC=CC=C4

InChI

InChI=1S/C24H25NO2S2/c1-17-9-12-21(13-10-17)29(26,27)25-16-24(28-20-7-5-4-6-8-20)23-15-18(2)11-14-22(23)19(25)3/h4-15,19,24H,16H2,1-3H3