2-(4-methylphenyl)-5-(4-pyrimidin-2-ylpiperazin-1-yl)-1,2,3-triazole-4-carbonitrile

Systemtic Name: 2-(4-methylphenyl)-5-(4-pyrimidin-2-ylpiperazin-1-yl)-1,2,3-triazole-4-carbonitrile Openeye Name: 2-(p-tolyl)-5-(4-pyrimidin-2-ylpiperazin-1-yl)triazole-4-carbonitrile CAS Name: 2-(4-methylphenyl)-5-[4-(2-pyrimidinyl)-1-piperazinyl]-4-triazolecarbonitrile IUPAC Name: 2-(4-methylphenyl)-5-(4-pyrimidin-2-ylpiperazin-1-yl)triazole-4-carbonitrile Traditional Name: 2-(p-tolyl)-5-[4-(2-pyrimidyl)piperazino]triazole-4-carbonitrile Formula: C18H18N8 MolecularWeight: 346.38912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2N=C(C(=N2)N3CCN(CC3)C4=NC=CC=N4)C#N

Isomeric SMILES

CC1=CC=C(C=C1)N2N=C(C(=N2)N3CCN(CC3)C4=NC=CC=N4)C#N

InChI

InChI=1S/C18H18N8/c1-14-3-5-15(6-4-14)26-22-16(13-19)17(23-26)24-9-11-25(12-10-24)18-20-7-2-8-21-18/h2-8H,9-12H2,1H3