4-[2-(2-piperidin-1-ylpiperidin-1-yl)pyrimidin-5-yl]benzenecarbonitrile

Systemtic Name: 4-[2-(2-piperidin-1-ylpiperidin-1-yl)pyrimidin-5-yl]benzenecarbonitrile Openeye Name: 4-[2-[2-(1-piperidyl)-1-piperidyl]pyrimidin-5-yl]benzonitrile CAS Name: 4-[2-[2-(1-piperidinyl)-1-piperidinyl]-5-pyrimidinyl]benzonitrile IUPAC Name: 4-[2-(2-piperidin-1-ylpiperidin-1-yl)pyrimidin-5-yl]benzonitrile Traditional Name: 4-[2-(2-piperidinopiperidino)pyrimidin-5-yl]benzonitrile Formula: C21H25N5 MolecularWeight: 347.4567

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCCCN2C3=NC=C(C=N3)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1CCN(CC1)C2CCCCN2C3=NC=C(C=N3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C21H25N5/c22-14-17-7-9-18(10-8-17)19-15-23-21(24-16-19)26-13-5-2-6-20(26)25-11-3-1-4-12-25/h7-10,15-16,20H,1-6,11-13H2