3-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-5-(4-methylphenyl)-1,3,4-oxadiazole-2-thione

Systemtic Name: 3-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-5-(4-methylphenyl)-1,3,4-oxadiazole-2-thione Openeye Name: 3-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-5-(p-tolyl)-1,3,4-oxadiazole-2-thione CAS Name: 3-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-5-(4-methylphenyl)-1,3,4-oxadiazole-2-thione IUPAC Name: 3-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-5-(4-methylphenyl)-1,3,4-oxadiazole-2-thione Traditional Name: 3-[(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-5-(p-tolyl)-1,3,4-oxadiazole-2-thione Formula: C27H27N3O3S MolecularWeight: 473.58658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=S)O2)CN3CCC4=CC(=C(C=C4C3C5=CC=CC=C5)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=S)O2)CN3CCC4=CC(=C(C=C4C3C5=CC=CC=C5)OC)OC

InChI

InChI=1S/C27H27N3O3S/c1-18-9-11-20(12-10-18)26-28-30(27(34)33-26)17-29-14-13-21-15-23(31-2)24(32-3)16-22(21)25(29)19-7-5-4-6-8-19/h4-12,15-16,25H,13-14,17H2,1-3H3