5-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-2H-benzotriazole

Systemtic Name: 5-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-2H-benzotriazole Openeye Name: 5-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-2H-benzotriazole CAS Name: 5-[2-[4-(2-pyrimidinyl)-1-piperazinyl]ethyl]-2H-benzotriazole IUPAC Name: 5-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]-2H-benzotriazole Traditional Name: 5-[2-[4-(2-pyrimidyl)piperazino]ethyl]-2H-benzotriazole Formula: C16H19N7 MolecularWeight: 309.36896

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC3=NNN=C3C=C2)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CCC2=CC3=NNN=C3C=C2)C4=NC=CC=N4

InChI

InChI=1S/C16H19N7/c1-5-17-16(18-6-1)23-10-8-22(9-11-23)7-4-13-2-3-14-15(12-13)20-21-19-14/h1-3,5-6,12H,4,7-11H2,(H,19,20,21)