[4-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]phenyl]-piperazin-1-yl-methanone

Systemtic Name: [4-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]phenyl]-piperazin-1-yl-methanone Openeye Name: [4-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]phenyl]-piperazin-1-yl-methanone CAS Name: [4-[[4-(4-chlorophenyl)-2-pyrimidinyl]amino]phenyl]-(1-piperazinyl)methanone IUPAC Name: [4-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]phenyl]-piperazin-1-ylmethanone Traditional Name: [4-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]phenyl]-piperazino-methanone Formula: C21H20ClN5O MolecularWeight: 393.8694

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1)C(=O)C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H20ClN5O/c22-17-5-1-15(2-6-17)19-9-10-24-21(26-19)25-18-7-3-16(4-8-18)20(28)27-13-11-23-12-14-27/h1-10,23H,11-14H2,(H,24,25,26)