1-thiophen-2-yl-4-[[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]methyl]-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-thiophen-2-yl-4-[[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]methyl]-1,2,3,4-tetrazol-5-one Openeye Name: 1-(2-thienyl)-4-[[4-(2-thienylmethyl)piperazin-1-ium-1-yl]methyl]tetrazol-5-one CAS Name: 1-thiophen-2-yl-4-[[4-(thiophen-2-ylmethyl)-1-piperazin-1-iumyl]methyl]-5-tetrazolone IUPAC Name: 1-thiophen-2-yl-4-[[4-(thiophen-2-ylmethyl)piperazin-1-ium-1-yl]methyl]tetrazol-5-one Traditional Name: 1-[[4-(2-thenyl)piperazin-1-ium-1-yl]methyl]-4-(2-thienyl)tetrazol-5-one Formula: C15H19N6OS2+ MolecularWeight: 363.48096

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C(=O)N(N=N2)C3=CC=CS3)CC4=CC=CS4

Isomeric SMILES

C1CN(CC[NH+]1CN2C(=O)N(N=N2)C3=CC=CS3)CC4=CC=CS4

InChI

InChI=1S/C15H18N6OS2/c22-15-20(16-17-21(15)14-4-2-10-24-14)12-19-7-5-18(6-8-19)11-13-3-1-9-23-13/h1-4,9-10H,5-8,11-12H2/p+1