3-[2-[(4-hydroxyphenyl)amino]pyrimidin-4-yl]benzenecarbonitrile

Systemtic Name: 3-[2-[(4-hydroxyphenyl)amino]pyrimidin-4-yl]benzenecarbonitrile Openeye Name: 3-[2-(4-hydroxyanilino)pyrimidin-4-yl]benzonitrile CAS Name: 3-[2-(4-hydroxyanilino)-4-pyrimidinyl]benzonitrile IUPAC Name: 3-[2-(4-hydroxyanilino)pyrimidin-4-yl]benzonitrile Traditional Name: 3-[2-(4-hydroxyanilino)pyrimidin-4-yl]benzonitrile Formula: C17H12N4O MolecularWeight: 288.30338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12N4O/c18-11-12-2-1-3-13(10-12)16-8-9-19-17(21-16)20-14-4-6-15(22)7-5-14/h1-10,22H,(H,19,20,21)