2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[(1-cyclopentyl-5-tetrazolyl)thio]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(1-cyclopentyltetrazol-5-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(1-cyclopentyltetrazol-5-yl)thio]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C16H22N8OS MolecularWeight: 374.46388

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=NN=N2)SCC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CCC(C1)N2C(=NN=N2)SCC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C16H22N8OS/c25-14(12-26-16-19-20-21-24(16)13-4-1-2-5-13)22-8-10-23(11-9-22)15-17-6-3-7-18-15/h3,6-7,13H,1-2,4-5,8-12H2