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

Systemtic Name: 2-[5-(2-methylphenyl)-1,2,3,4-tetrazol-2-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[5-(o-tolyl)tetrazol-2-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[5-(2-methylphenyl)-2-tetrazolyl]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[5-(2-methylphenyl)tetrazol-2-yl]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[5-(o-tolyl)tetrazol-2-yl]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C18H20N8O MolecularWeight: 364.4044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN(N=N2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=CC=CC=C1C2=NN(N=N2)CC(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C18H20N8O/c1-14-5-2-3-6-15(14)17-21-23-26(22-17)13-16(27)24-9-11-25(12-10-24)18-19-7-4-8-20-18/h2-8H,9-13H2,1H3