4-[[(2-azanyl-6-chloranyl-pyrimidin-4-yl)-methyl-amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[(2-azanyl-6-chloranyl-pyrimidin-4-yl)-methyl-amino]methyl]benzenecarbonitrile Openeye Name: 4-[[(2-amino-6-chloro-pyrimidin-4-yl)-methyl-amino]methyl]benzonitrile CAS Name: 4-[[(2-amino-6-chloro-4-pyrimidinyl)-methylamino]methyl]benzonitrile IUPAC Name: 4-[[(2-amino-6-chloropyrimidin-4-yl)-methylamino]methyl]benzonitrile Traditional Name: 4-[[(2-amino-6-chloro-pyrimidin-4-yl)-methyl-amino]methyl]benzonitrile Formula: C13H12ClN5 MolecularWeight: 273.72088

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C#N)C2=CC(=NC(=N2)N)Cl

Isomeric SMILES

CN(CC1=CC=C(C=C1)C#N)C2=CC(=NC(=N2)N)Cl

InChI

InChI=1S/C13H12ClN5/c1-19(12-6-11(14)17-13(16)18-12)8-10-4-2-9(7-15)3-5-10/h2-6H,8H2,1H3,(H2,16,17,18)