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

Systemtic Name: methyl-[(4-methylsulfanylphenyl)methyl]-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]azanium Openeye Name: methyl-[(4-methylsulfanylphenyl)methyl]-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]ammonium CAS Name: methyl-[[4-(methylthio)phenyl]methyl]-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]ammonium IUPAC Name: methyl-[(4-methylsulfanylphenyl)methyl]-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]azanium Traditional Name: methyl-[4-(methylthio)benzyl]-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]ammonium Formula: C18H20N3OS+ MolecularWeight: 326.4359

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3OS/c1-21(12-14-8-10-16(23-2)11-9-14)13-17-19-18(20-22-17)15-6-4-3-5-7-15/h3-11H,12-13H2,1-2H3/p+1