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

Systemtic Name: 4-azanyl-2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]pyrimidine-5-carbonitrile Openeye Name: 4-amino-2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]pyrimidine-5-carbonitrile CAS Name: 4-amino-2-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-5-pyrimidinecarbonitrile IUPAC Name: 4-amino-2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]pyrimidine-5-carbonitrile Traditional Name: 4-amino-2-[4-(4-chlorobenzyl)piperazino]pyrimidine-5-carbonitrile Formula: C16H17ClN6 MolecularWeight: 328.79938

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)Cl)C3=NC=C(C(=N3)N)C#N

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)Cl)C3=NC=C(C(=N3)N)C#N

InChI

InChI=1S/C16H17ClN6/c17-14-3-1-12(2-4-14)11-22-5-7-23(8-6-22)16-20-10-13(9-18)15(19)21-16/h1-4,10H,5-8,11H2,(H2,19,20,21)