2-(3-phenyl-1H-1,2,4-triazol-5-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(3-phenyl-1H-1,2,4-triazol-5-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(3-phenyl-1H-1,2,4-triazol-5-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-(3-phenyl-1H-1,2,4-triazol-5-yl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3-phenyl-1H-1,2,4-triazol-5-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-(3-phenyl-1H-1,2,4-triazol-5-yl)-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C18H19N7O MolecularWeight: 349.38976

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CC3=NC(=NN3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CC3=NC(=NN3)C4=CC=CC=C4

InChI

InChI=1S/C18H19N7O/c26-16(13-15-21-17(23-22-15)14-5-2-1-3-6-14)24-9-11-25(12-10-24)18-19-7-4-8-20-18/h1-8H,9-13H2,(H,21,22,23)