4-[[4-[cyano(phenyl)methyl]pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-[cyano(phenyl)methyl]pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-[cyano(phenyl)methyl]pyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-[cyano(phenyl)methyl]-2-pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-[cyano(phenyl)methyl]pyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-[cyano(phenyl)methyl]pyrimidin-2-yl]amino]benzonitrile Formula: C19H13N5 MolecularWeight: 311.34002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)C2=NC(=NC=C2)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(C#N)C2=NC(=NC=C2)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H13N5/c20-12-14-6-8-16(9-7-14)23-19-22-11-10-18(24-19)17(13-21)15-4-2-1-3-5-15/h1-11,17H,(H,22,23,24)