2-[4-(3-chlorophenyl)piperazin-1-yl]pyrimidine-5-carbonitrile

Systemtic Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]pyrimidine-5-carbonitrile Openeye Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]pyrimidine-5-carbonitrile CAS Name: 2-[4-(3-chlorophenyl)-1-piperazinyl]-5-pyrimidinecarbonitrile IUPAC Name: 2-[4-(3-chlorophenyl)piperazin-1-yl]pyrimidine-5-carbonitrile Traditional Name: 2-[4-(3-chlorophenyl)piperazino]pyrimidine-5-carbonitrile Formula: C15H14ClN5 MolecularWeight: 299.75816

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=NC=C(C=N3)C#N

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=NC=C(C=N3)C#N

InChI

InChI=1S/C15H14ClN5/c16-13-2-1-3-14(8-13)20-4-6-21(7-5-20)15-18-10-12(9-17)11-19-15/h1-3,8,10-11H,4-7H2