2-fluoranyl-6-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylamino]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-6-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylamino]benzenecarbonitrile Openeye Name: 2-fluoro-6-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylamino]benzonitrile CAS Name: 2-fluoro-6-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propylamino]benzonitrile IUPAC Name: 2-fluoro-6-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propylamino]benzonitrile Traditional Name: 2-fluoro-6-[3-[4-(2-pyrimidyl)piperazino]propylamino]benzonitrile Formula: C18H21FN6 MolecularWeight: 340.397943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC2=C(C(=CC=C2)F)C#N)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1CCCNC2=C(C(=CC=C2)F)C#N)C3=NC=CC=N3

InChI

InChI=1S/C18H21FN6/c19-16-4-1-5-17(15(16)14-20)21-8-3-9-24-10-12-25(13-11-24)18-22-6-2-7-23-18/h1-2,4-7,21H,3,8-13H2