2-chloranyl-4-[4-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-1-yl]benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-[4-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-1-yl]benzenecarbonitrile Openeye Name: 2-chloro-4-[4-(1-pyrazin-2-yl-4-piperidyl)-1-piperidyl]benzonitrile CAS Name: 2-chloro-4-[4-[1-(2-pyrazinyl)-4-piperidinyl]-1-piperidinyl]benzonitrile IUPAC Name: 2-chloro-4-[4-(1-pyrazin-2-ylpiperidin-4-yl)piperidin-1-yl]benzonitrile Traditional Name: 2-chloro-4-[4-(1-pyrazin-2-yl-4-piperidyl)piperidino]benzonitrile Formula: C21H24ClN5 MolecularWeight: 381.90176

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2CCN(CC2)C3=NC=CN=C3)C4=CC(=C(C=C4)C#N)Cl

Isomeric SMILES

C1CN(CCC1C2CCN(CC2)C3=NC=CN=C3)C4=CC(=C(C=C4)C#N)Cl

InChI

InChI=1S/C21H24ClN5/c22-20-13-19(2-1-18(20)14-23)26-9-3-16(4-10-26)17-5-11-27(12-6-17)21-15-24-7-8-25-21/h1-2,7-8,13,15-17H,3-6,9-12H2