4-[5-[(2-azanyl-6-chloranyl-pyrimidin-4-yl)amino]pyridin-2-yl]piperazin-2-one

Systemtic Name: 4-[5-[(2-azanyl-6-chloranyl-pyrimidin-4-yl)amino]pyridin-2-yl]piperazin-2-one Openeye Name: 4-[5-[(2-amino-6-chloro-pyrimidin-4-yl)amino]-2-pyridyl]piperazin-2-one CAS Name: 4-[5-[(2-amino-6-chloro-4-pyrimidinyl)amino]-2-pyridinyl]-2-piperazinone IUPAC Name: 4-[5-[(2-amino-6-chloropyrimidin-4-yl)amino]pyridin-2-yl]piperazin-2-one Traditional Name: 4-[5-[(2-amino-6-chloro-pyrimidin-4-yl)amino]-2-pyridyl]piperazin-2-one Formula: C13H14ClN7O MolecularWeight: 319.74956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC3=CC(=NC(=N3)N)Cl

Isomeric SMILES

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC3=CC(=NC(=N3)N)Cl

InChI

InChI=1S/C13H14ClN7O/c14-9-5-10(20-13(15)19-9)18-8-1-2-11(17-6-8)21-4-3-16-12(22)7-21/h1-2,5-6H,3-4,7H2,(H,16,22)(H3,15,18,19,20)