[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: [3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-[4-(methylthio)benzyl]ammonium Formula: C20H24N3OS+ MolecularWeight: 354.48906

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=N2)C[NH+](C)CC3=CC=C(C=C3)SC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=N2)C[NH+](C)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C20H23N3OS/c1-4-15-5-9-17(10-6-15)20-21-19(24-22-20)14-23(2)13-16-7-11-18(25-3)12-8-16/h5-12H,4,13-14H2,1-3H3/p+1