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

Systemtic Name: 2-[(4-hydroxyphenyl)methyl-pyrimidin-2-yl-amino]benzenecarbonitrile Openeye Name: 2-[(4-hydroxyphenyl)methyl-pyrimidin-2-yl-amino]benzonitrile CAS Name: 2-[(4-hydroxyphenyl)methyl-(2-pyrimidinyl)amino]benzonitrile IUPAC Name: 2-[(4-hydroxyphenyl)methyl-pyrimidin-2-ylamino]benzonitrile Traditional Name: 2-[(4-hydroxybenzyl)-(2-pyrimidyl)amino]benzonitrile Formula: C18H14N4O MolecularWeight: 302.32996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)N(CC2=CC=C(C=C2)O)C3=NC=CC=N3

Isomeric SMILES

C1=CC=C(C(=C1)C#N)N(CC2=CC=C(C=C2)O)C3=NC=CC=N3

InChI

InChI=1S/C18H14N4O/c19-12-15-4-1-2-5-17(15)22(18-20-10-3-11-21-18)13-14-6-8-16(23)9-7-14/h1-11,23H,13H2