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

Systemtic Name: (4-methoxyphenyl)methyl-methyl-[(4-methyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Openeye Name: (4-methoxyphenyl)methyl-methyl-[[4-methyl-3-(3-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium CAS Name: (4-methoxyphenyl)methyl-methyl-[[4-methyl-3-(3-pyridinyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]ammonium IUPAC Name: (4-methoxyphenyl)methyl-methyl-[(4-methyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: methyl-[[4-methyl-3-(3-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]-p-anisyl-ammonium Formula: C18H22N5OS+ MolecularWeight: 356.46518

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)C[NH+](C)CC2=CC=C(C=C2)OC)C3=CN=CC=C3

Isomeric SMILES

CN1C(=NN(C1=S)C[NH+](C)CC2=CC=C(C=C2)OC)C3=CN=CC=C3

InChI

InChI=1S/C18H21N5OS/c1-21(12-14-6-8-16(24-3)9-7-14)13-23-18(25)22(2)17(20-23)15-5-4-10-19-11-15/h4-11H,12-13H2,1-3H3/p+1