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

Systemtic Name: 1-benzothiophen-2-ylmethyl-methyl-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium Openeye Name: benzothiophen-2-ylmethyl-methyl-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium CAS Name: 1-benzothiophen-2-ylmethyl-methyl-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]ammonium IUPAC Name: 1-benzothiophen-2-ylmethyl-methyl-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]azanium Traditional Name: benzothiophen-2-ylmethyl-methyl-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]ammonium Formula: C17H16N3OS2+ MolecularWeight: 342.45844

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC2=CC=CC=C2S1)CC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C[NH+](CC1=CC2=CC=CC=C2S1)CC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C17H15N3OS2/c1-20(10-13-9-12-5-2-3-6-14(12)23-13)11-16-18-17(19-21-16)15-7-4-8-22-15/h2-9H,10-11H2,1H3/p+1