4-[[[2-(4-fluorophenyl)-4-oxidanylidene-pteridin-3-yl]amino]methyl]benzenecarbonitrile

Systemtic Name: 4-[[[2-(4-fluorophenyl)-4-oxidanylidene-pteridin-3-yl]amino]methyl]benzenecarbonitrile Openeye Name: 4-[[[2-(4-fluorophenyl)-4-oxo-pteridin-3-yl]amino]methyl]benzonitrile CAS Name: 4-[[[2-(4-fluorophenyl)-4-oxo-3-pteridinyl]amino]methyl]benzonitrile IUPAC Name: 4-[[[2-(4-fluorophenyl)-4-oxopteridin-3-yl]amino]methyl]benzonitrile Traditional Name: 4-[[[2-(4-fluorophenyl)-4-keto-pteridin-3-yl]amino]methyl]benzonitrile Formula: C20H13FN6O MolecularWeight: 372.355223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNN2C(=NC3=NC=CN=C3C2=O)C4=CC=C(C=C4)F)C#N

Isomeric SMILES

C1=CC(=CC=C1CNN2C(=NC3=NC=CN=C3C2=O)C4=CC=C(C=C4)F)C#N

InChI

InChI=1S/C20H13FN6O/c21-16-7-5-15(6-8-16)19-26-18-17(23-9-10-24-18)20(28)27(19)25-12-14-3-1-13(11-22)2-4-14/h1-10,25H,12H2