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

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

Systemtic Name:5-cyclopropyl-2-[(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-4-ethyl-1,2,4-triazole-3-thione
Openeye Name:5-cyclopropyl-2-[(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-4-ethyl-1,2,4-triazole-3-thione
CAS Name:5-cyclopropyl-2-[(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-4-ethyl-1,2,4-triazole-3-thione
IUPAC Name:5-cyclopropyl-2-[(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-4-ethyl-1,2,4-triazole-3-thione
Traditional Name:5-cyclopropyl-2-[(6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)methyl]-4-ethyl-1,2,4-triazole-3-thione
Formula: C21H31N4O2S+
MolecularWeight: 403.56144
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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)C[NH+]2CCC3=CC(=C(C=C3C2)OCC)OCC)C4CC4


Isomeric SMILES

CCN1C(=NN(C1=S)C[NH+]2CCC3=CC(=C(C=C3C2)OCC)OCC)C4CC4


InChI

InChI=1S/C21H30N4O2S/c1-4-24-20(15-7-8-15)22-25(21(24)28)14-23-10-9-16-11-18(26-5-2)19(27-6-3)12-17(16)13-23/h11-12,15H,4-10,13-14H2,1-3H3/p+1


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