1-methyl-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,2,3,4-tetrazole-5-thione

Systemtic Name: 1-methyl-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-1,2,3,4-tetrazole-5-thione Openeye Name: 1-methyl-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)tetrazole-5-thione CAS Name: 1-methyl-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)-5-tetrazolethione IUPAC Name: 1-methyl-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)tetrazole-5-thione Traditional Name: 1-methyl-4-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)tetrazole-5-thione Formula: C12H16N5S+ MolecularWeight: 262.35394

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=S)N(N=N1)C[NH+]2CCC3=CC=CC=C3C2

Isomeric SMILES

CN1C(=S)N(N=N1)C[NH+]2CCC3=CC=CC=C3C2

InChI

InChI=1S/C12H15N5S/c1-15-12(18)17(14-13-15)9-16-7-6-10-4-2-3-5-11(10)8-16/h2-5H,6-9H2,1H3/p+1