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

Systemtic Name: 3-[2-[(4-methoxyphenyl)amino]pyrimidin-4-yl]benzenecarbonitrile Openeye Name: 3-[2-(4-methoxyanilino)pyrimidin-4-yl]benzonitrile CAS Name: 3-[2-(4-methoxyanilino)-4-pyrimidinyl]benzonitrile IUPAC Name: 3-[2-(4-methoxyanilino)pyrimidin-4-yl]benzonitrile Traditional Name: 3-[2-(p-anisidino)pyrimidin-4-yl]benzonitrile Formula: C18H14N4O MolecularWeight: 302.32996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CC=CC(=C3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H14N4O/c1-23-16-7-5-15(6-8-16)21-18-20-10-9-17(22-18)14-4-2-3-13(11-14)12-19/h2-11H,1H3,(H,20,21,22)