4-cyclopropyl-2-[(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-1,2,4-triazole-3-thione

Systemtic Name: 4-cyclopropyl-2-[(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-2-[(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-2-[(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-2-[(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-2-[(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-1,2,4-triazole-3-thione Formula: C19H27N4O2S+ MolecularWeight: 375.50828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C[NH+](CCC2=C1)CN3C(=S)N(C=N3)C4CC4)OCC

Isomeric SMILES

CCOC1=C(C=C2C[NH+](CCC2=C1)CN3C(=S)N(C=N3)C4CC4)OCC

InChI

InChI=1S/C19H26N4O2S/c1-3-24-17-9-14-7-8-21(11-15(14)10-18(17)25-4-2)13-23-19(26)22(12-20-23)16-5-6-16/h9-10,12,16H,3-8,11,13H2,1-2H3/p+1