4-[(5-azanyl-6-chloranyl-pyrimidin-4-yl)amino]benzenecarbonitrile

Systemtic Name: 4-[(5-azanyl-6-chloranyl-pyrimidin-4-yl)amino]benzenecarbonitrile Openeye Name: 4-[(5-amino-6-chloro-pyrimidin-4-yl)amino]benzonitrile CAS Name: 4-[(5-amino-6-chloro-4-pyrimidinyl)amino]benzonitrile IUPAC Name: 4-[(5-amino-6-chloropyrimidin-4-yl)amino]benzonitrile Traditional Name: 4-[(5-amino-6-chloro-pyrimidin-4-yl)amino]benzonitrile Formula: C11H8ClN5 MolecularWeight: 245.66772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC2=C(C(=NC=N2)Cl)N

Isomeric SMILES

C1=CC(=CC=C1C#N)NC2=C(C(=NC=N2)Cl)N

InChI

InChI=1S/C11H8ClN5/c12-10-9(14)11(16-6-15-10)17-8-3-1-7(5-13)2-4-8/h1-4,6H,14H2,(H,15,16,17)