2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-5-(4-methoxyphenyl)-1H-1,2,4-triazole-3-thione Formula: C19H20N4OS MolecularWeight: 352.4533

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=S)N(N2)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=S)N(N2)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C19H20N4OS/c1-24-17-8-6-15(7-9-17)18-20-19(25)23(21-18)13-22-11-10-14-4-2-3-5-16(14)12-22/h2-9H,10-13H2,1H3,(H,20,21,25)