2-(benzotriazol-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(benzotriazol-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(benzotriazol-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-(1-benzotriazolyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(benzotriazol-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-(benzotriazol-1-yl)-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C16H17N7O MolecularWeight: 323.35248

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C16H17N7O/c24-15(12-23-14-5-2-1-4-13(14)19-20-23)21-8-10-22(11-9-21)16-17-6-3-7-18-16/h1-7H,8-12H2