[4-(2-methoxyethyl)-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-dimethyl-azanium

Systemtic Name: [4-(2-methoxyethyl)-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-dimethyl-azanium Openeye Name: [4-(2-methoxyethyl)-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-dimethyl-ammonium CAS Name: [4-(2-methoxyethyl)-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-dimethylammonium IUPAC Name: [4-(2-methoxyethyl)-3-pyridin-4-yl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-dimethylazanium Traditional Name: [4-(2-methoxyethyl)-3-(4-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl-dimethyl-ammonium Formula: C13H20N5OS+ MolecularWeight: 294.3958

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CN1C(=S)N(C(=N1)C2=CC=NC=C2)CCOC

Isomeric SMILES

C[NH+](C)CN1C(=S)N(C(=N1)C2=CC=NC=C2)CCOC

InChI

InChI=1S/C13H19N5OS/c1-16(2)10-18-13(20)17(8-9-19-3)12(15-18)11-4-6-14-7-5-11/h4-7H,8-10H2,1-3H3/p+1