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

Systemtic Name: cyclohexyl-[[4-methyl-5-(phenylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]azanium Openeye Name: (5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl-cyclohexyl-ammonium CAS Name: cyclohexyl-[[4-methyl-5-(phenylmethylthio)-1,2,4-triazol-3-yl]methyl]ammonium IUPAC Name: (5-benzylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl-cyclohexylazanium Traditional Name: [5-(benzylthio)-4-methyl-1,2,4-triazol-3-yl]methyl-cyclohexyl-ammonium Formula: C17H25N4S+ MolecularWeight: 317.4722

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=CC=C2)C[NH2+]C3CCCCC3

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=CC=C2)C[NH2+]C3CCCCC3

InChI

InChI=1S/C17H24N4S/c1-21-16(12-18-15-10-6-3-7-11-15)19-20-17(21)22-13-14-8-4-2-5-9-14/h2,4-5,8-9,15,18H,3,6-7,10-13H2,1H3/p+1