4-[1-(4-nitrophenyl)ethyl-pyrimidin-5-yl-amino]benzenecarbonitrile

Systemtic Name: 4-[1-(4-nitrophenyl)ethyl-pyrimidin-5-yl-amino]benzenecarbonitrile Openeye Name: 4-[1-(4-nitrophenyl)ethyl-pyrimidin-5-yl-amino]benzonitrile CAS Name: 4-[1-(4-nitrophenyl)ethyl-(5-pyrimidinyl)amino]benzonitrile IUPAC Name: 4-[1-(4-nitrophenyl)ethyl-pyrimidin-5-ylamino]benzonitrile Traditional Name: 4-[1-(4-nitrophenyl)ethyl-(5-pyrimidyl)amino]benzonitrile Formula: C19H15N5O2 MolecularWeight: 345.3547

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)[N+](=O)[O-])N(C2=CC=C(C=C2)C#N)C3=CN=CN=C3

Isomeric SMILES

CC(C1=CC=C(C=C1)[N+](=O)[O-])N(C2=CC=C(C=C2)C#N)C3=CN=CN=C3

InChI

InChI=1S/C19H15N5O2/c1-14(16-4-8-18(9-5-16)24(25)26)23(19-11-21-13-22-12-19)17-6-2-15(10-20)3-7-17/h2-9,11-14H,1H3