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

Systemtic Name: cyclohexyl-methyl-[(4-methyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Openeye Name: cyclohexyl-methyl-[[4-methyl-3-(3-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium CAS Name: cyclohexyl-methyl-[[4-methyl-3-(3-pyridinyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]ammonium IUPAC Name: cyclohexyl-methyl-[(4-methyl-3-pyridin-3-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: cyclohexyl-methyl-[[4-methyl-3-(3-pyridyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium Formula: C16H24N5S+ MolecularWeight: 318.46026

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)C[NH+](C)C2CCCCC2)C3=CN=CC=C3

Isomeric SMILES

CN1C(=NN(C1=S)C[NH+](C)C2CCCCC2)C3=CN=CC=C3

InChI

InChI=1S/C16H23N5S/c1-19(14-8-4-3-5-9-14)12-21-16(22)20(2)15(18-21)13-7-6-10-17-11-13/h6-7,10-11,14H,3-5,8-9,12H2,1-2H3/p+1