4-[(phenylmethyl)-pyrimidin-5-yl-amino]benzenecarbonitrile

Systemtic Name: 4-[(phenylmethyl)-pyrimidin-5-yl-amino]benzenecarbonitrile Openeye Name: 4-[benzyl(pyrimidin-5-yl)amino]benzonitrile CAS Name: 4-[(phenylmethyl)-(5-pyrimidinyl)amino]benzonitrile IUPAC Name: 4-[benzyl(pyrimidin-5-yl)amino]benzonitrile Traditional Name: 4-[benzyl(5-pyrimidyl)amino]benzonitrile Formula: C18H14N4 MolecularWeight: 286.33056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=C(C=C2)C#N)C3=CN=CN=C3

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=C(C=C2)C#N)C3=CN=CN=C3

InChI

InChI=1S/C18H14N4/c19-10-15-6-8-17(9-7-15)22(18-11-20-14-21-12-18)13-16-4-2-1-3-5-16/h1-9,11-12,14H,13H2