[1-[[1-(2-phenylsulfanylethanoyl)piperidin-4-yl]methyl]-1,2,3-triazol-4-yl]methylazanium

Systemtic Name: [1-[[1-(2-phenylsulfanylethanoyl)piperidin-4-yl]methyl]-1,2,3-triazol-4-yl]methylazanium Openeye Name: [1-[[1-(2-phenylsulfanylacetyl)-4-piperidyl]methyl]triazol-4-yl]methylammonium CAS Name: [1-[[1-[1-oxo-2-(phenylthio)ethyl]-4-piperidinyl]methyl]-4-triazolyl]methylammonium IUPAC Name: [1-[[1-(2-phenylsulfanylacetyl)piperidin-4-yl]methyl]triazol-4-yl]methylazanium Traditional Name: [1-[[1-[2-(phenylthio)acetyl]-4-piperidyl]methyl]triazol-4-yl]methylammonium Formula: C17H24N5OS+ MolecularWeight: 346.47036

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C=C(N=N2)C[NH3+])C(=O)CSC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1CN2C=C(N=N2)C[NH3+])C(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C17H23N5OS/c18-10-15-12-22(20-19-15)11-14-6-8-21(9-7-14)17(23)13-24-16-4-2-1-3-5-16/h1-5,12,14H,6-11,13,18H2/p+1