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

Systemtic Name: [3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: [3-(2-furyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: [3-(2-furanyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: [3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl-methyl-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: [3-(2-furyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-[4-(methylthio)benzyl]ammonium Formula: C16H18N3O2S+ MolecularWeight: 316.39802

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)SC)CC2=NC(=NO2)C3=CC=CO3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)SC)CC2=NC(=NO2)C3=CC=CO3

InChI

InChI=1S/C16H17N3O2S/c1-19(10-12-5-7-13(22-2)8-6-12)11-15-17-16(18-21-15)14-4-3-9-20-14/h3-9H,10-11H2,1-2H3/p+1