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

Systemtic Name: 5-(4-chlorophenyl)-2-[4-(phenylmethyl)piperazin-1-yl]pyrimidine Openeye Name: 2-(4-benzylpiperazin-1-yl)-5-(4-chlorophenyl)pyrimidine CAS Name: 5-(4-chlorophenyl)-2-[4-(phenylmethyl)-1-piperazinyl]pyrimidine IUPAC Name: 2-(4-benzylpiperazin-1-yl)-5-(4-chlorophenyl)pyrimidine Traditional Name: 2-(4-benzylpiperazino)-5-(4-chlorophenyl)pyrimidine Formula: C21H21ClN4 MolecularWeight: 364.87124

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=NC=C(C=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=NC=C(C=N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H21ClN4/c22-20-8-6-18(7-9-20)19-14-23-21(24-15-19)26-12-10-25(11-13-26)16-17-4-2-1-3-5-17/h1-9,14-15H,10-13,16H2