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

Systemtic Name: 3-[[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-1,3,4-thiadiazole-2-thione Openeye Name: 3-[[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-1,3,4-thiadiazole-2-thione CAS Name: 3-[[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-1,3,4-thiadiazole-2-thione IUPAC Name: 3-[[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-1,3,4-thiadiazole-2-thione Traditional Name: 3-[[(1R)-6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl]methyl]-1,3,4-thiadiazole-2-thione Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CN3C(=S)SC=N3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2[C@H](N(CCC2=C1)CN3C(=S)SC=N3)C4=CC=CC=C4)OC

InChI

InChI=1S/C20H21N3O2S2/c1-24-17-10-15-8-9-22(13-23-20(26)27-12-21-23)19(14-6-4-3-5-7-14)16(15)11-18(17)25-2/h3-7,10-12,19H,8-9,13H2,1-2H3/t19-/m1/s1