5-[(4-phenylpiperazin-1-ium-1-yl)methyl]-3-thiophen-2-yl-1,2,4-oxadiazole

Systemtic Name: 5-[(4-phenylpiperazin-1-ium-1-yl)methyl]-3-thiophen-2-yl-1,2,4-oxadiazole Openeye Name: 5-[(4-phenylpiperazin-1-ium-1-yl)methyl]-3-(2-thienyl)-1,2,4-oxadiazole CAS Name: 5-[(4-phenyl-1-piperazin-1-iumyl)methyl]-3-thiophen-2-yl-1,2,4-oxadiazole IUPAC Name: 5-[(4-phenylpiperazin-1-ium-1-yl)methyl]-3-thiophen-2-yl-1,2,4-oxadiazole Traditional Name: 5-[(4-phenylpiperazin-1-ium-1-yl)methyl]-3-(2-thienyl)-1,2,4-oxadiazole Formula: C17H19N4OS+ MolecularWeight: 327.42396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC(=NO2)C3=CC=CS3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC(=NO2)C3=CC=CS3)C4=CC=CC=C4

InChI

InChI=1S/C17H18N4OS/c1-2-5-14(6-3-1)21-10-8-20(9-11-21)13-16-18-17(19-22-16)15-7-4-12-23-15/h1-7,12H,8-11,13H2/p+1