2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-ethanoylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(1-tert-butyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-ethanoylpiperazin-1-yl)ethanone Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-(1-tert-butyltetrazol-5-yl)sulfanyl-ethanone CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[(1-tert-butyl-5-tetrazolyl)thio]ethanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-(1-tert-butyltetrazol-5-yl)sulfanylethanone Traditional Name: 1-(4-acetylpiperazino)-2-[(1-tert-butyltetrazol-5-yl)thio]ethanone Formula: C13H22N6O2S MolecularWeight: 326.41778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CSC2=NN=NN2C(C)(C)C

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CSC2=NN=NN2C(C)(C)C

InChI

InChI=1S/C13H22N6O2S/c1-10(20)17-5-7-18(8-6-17)11(21)9-22-12-14-15-16-19(12)13(2,3)4/h5-9H2,1-4H3