methyl-[[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-(thiophen-3-ylmethyl)azanium

Systemtic Name: methyl-[[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-(thiophen-3-ylmethyl)azanium Openeye Name: methyl-[[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-(3-thienylmethyl)ammonium CAS Name: methyl-[[4-methyl-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]methyl]-(3-thiophenylmethyl)ammonium IUPAC Name: methyl-[[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-(thiophen-3-ylmethyl)azanium Traditional Name: methyl-[[4-methyl-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]methyl]-(3-thenyl)ammonium Formula: C18H23N4OS2+ MolecularWeight: 375.53142

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCOC2=CC=CC=C2)C[NH+](C)CC3=CSC=C3

Isomeric SMILES

CN1C(=NN=C1SCCOC2=CC=CC=C2)C[NH+](C)CC3=CSC=C3

InChI

InChI=1S/C18H22N4OS2/c1-21(12-15-8-10-24-14-15)13-17-19-20-18(22(17)2)25-11-9-23-16-6-4-3-5-7-16/h3-8,10,14H,9,11-13H2,1-2H3/p+1