bis[4-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]phenyl]methanone; piperazine

Systemtic Name: bis[4-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]phenyl]methanone; piperazine Openeye Name: bis[4-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]phenyl]methanone; piperazine CAS Name: bis[4-[[4-(4-chlorophenyl)-2-pyrimidinyl]amino]phenyl]methanone; piperazine IUPAC Name: bis[4-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]phenyl]methanone; piperazine Traditional Name: bis[4-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]phenyl]methanone; piperazine Formula: C37H32Cl2N8O MolecularWeight: 675.60898

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN1.C1=CC(=CC=C1C2=NC(=NC=C2)NC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)NC5=NC=CC(=N5)C6=CC=C(C=C6)Cl)Cl

Isomeric SMILES

C1CNCCN1.C1=CC(=CC=C1C2=NC(=NC=C2)NC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)NC5=NC=CC(=N5)C6=CC=C(C=C6)Cl)Cl

InChI

InChI=1S/C33H22Cl2N6O.C4H10N2/c34-25-9-1-21(2-10-25)29-17-19-36-32(40-29)38-27-13-5-23(6-14-27)31(42)24-7-15-28(16-8-24)39-33-37-20-18-30(41-33)22-3-11-26(35)12-4-22;1-2-6-4-3-5-1/h1-20H,(H,36,38,40)(H,37,39,41);5-6H,1-4H2