4-[(4-cyanophenyl)-oxidanyl-pyrimidin-5-yl-methyl]benzenecarbonitrile

Systemtic Name: 4-[(4-cyanophenyl)-oxidanyl-pyrimidin-5-yl-methyl]benzenecarbonitrile Openeye Name: 4-[(4-cyanophenyl)-hydroxy-pyrimidin-5-yl-methyl]benzonitrile CAS Name: 4-[(4-cyanophenyl)-hydroxy-(5-pyrimidinyl)methyl]benzonitrile IUPAC Name: 4-[(4-cyanophenyl)-hydroxy-pyrimidin-5-ylmethyl]benzonitrile Traditional Name: 4-[(4-cyanophenyl)-hydroxy-(5-pyrimidyl)methyl]benzonitrile Formula: C19H12N4O MolecularWeight: 312.32478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(C2=CC=C(C=C2)C#N)(C3=CN=CN=C3)O

Isomeric SMILES

C1=CC(=CC=C1C#N)C(C2=CC=C(C=C2)C#N)(C3=CN=CN=C3)O

InChI

InChI=1S/C19H12N4O/c20-9-14-1-5-16(6-2-14)19(24,18-11-22-13-23-12-18)17-7-3-15(10-21)4-8-17/h1-8,11-13,24H