1-pyrrolidin-1-yl-2-[4-[2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoyl]piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-pyrrolidin-1-yl-2-[4-[2-(5-thiophen-2-yl-1,2,3,4-tetrazol-2-yl)ethanoyl]piperazin-1-ium-1-yl]ethanone Openeye Name: 1-pyrrolidin-1-yl-2-[4-[2-[5-(2-thienyl)tetrazol-2-yl]acetyl]piperazin-1-ium-1-yl]ethanone CAS Name: 2-[4-[1-oxo-2-(5-thiophen-2-yl-2-tetrazolyl)ethyl]-1-piperazin-1-iumyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 1-pyrrolidin-1-yl-2-[4-[2-(5-thiophen-2-yltetrazol-2-yl)acetyl]piperazin-1-ium-1-yl]ethanone Traditional Name: 1-pyrrolidino-2-[4-[2-[5-(2-thienyl)tetrazol-2-yl]acetyl]piperazin-1-ium-1-yl]ethanone Formula: C17H24N7O2S+ MolecularWeight: 390.48316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)CN3N=C(N=N3)C4=CC=CS4

Isomeric SMILES

C1CCN(C1)C(=O)C[NH+]2CCN(CC2)C(=O)CN3N=C(N=N3)C4=CC=CS4

InChI

InChI=1S/C17H23N7O2S/c25-15(22-5-1-2-6-22)12-21-7-9-23(10-8-21)16(26)13-24-19-17(18-20-24)14-4-3-11-27-14/h3-4,11H,1-2,5-10,12-13H2/p+1