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

Systemtic Name: 2-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(1-cyclohexyltetrazol-5-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[(1-cyclohexyl-5-tetrazolyl)thio]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(1-cyclohexyltetrazol-5-yl)sulfanyl-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(1-cyclohexyltetrazol-5-yl)thio]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C17H24N8OS MolecularWeight: 388.49046

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=N2)SCC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CCC(CC1)N2C(=NN=N2)SCC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C17H24N8OS/c26-15(23-9-11-24(12-10-23)16-18-7-4-8-19-16)13-27-17-20-21-22-25(17)14-5-2-1-3-6-14/h4,7-8,14H,1-3,5-6,9-13H2