4-[4-[[(2-azanyl-6-chloranyl-pyrimidin-4-yl)amino]methyl]phenyl]piperazin-2-one

Systemtic Name: 4-[4-[[(2-azanyl-6-chloranyl-pyrimidin-4-yl)amino]methyl]phenyl]piperazin-2-one Openeye Name: 4-[4-[[(2-amino-6-chloro-pyrimidin-4-yl)amino]methyl]phenyl]piperazin-2-one CAS Name: 4-[4-[[(2-amino-6-chloro-4-pyrimidinyl)amino]methyl]phenyl]-2-piperazinone IUPAC Name: 4-[4-[[(2-amino-6-chloropyrimidin-4-yl)amino]methyl]phenyl]piperazin-2-one Traditional Name: 4-[4-[[(2-amino-6-chloro-pyrimidin-4-yl)amino]methyl]phenyl]piperazin-2-one Formula: C15H17ClN6O MolecularWeight: 332.78808

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)CNC3=CC(=NC(=N3)N)Cl

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)CNC3=CC(=NC(=N3)N)Cl

InChI

InChI=1S/C15H17ClN6O/c16-12-7-13(21-15(17)20-12)19-8-10-1-3-11(4-2-10)22-6-5-18-14(23)9-22/h1-4,7H,5-6,8-9H2,(H,18,23)(H3,17,19,20,21)