4-(4-azanylpyrazolo[3,4-d]pyrimidin-1-yl)-N-[(3-fluorophenyl)methyl]benzamide

Systemtic Name: 4-(4-azanylpyrazolo[3,4-d]pyrimidin-1-yl)-N-[(3-fluorophenyl)methyl]benzamide Openeye Name: 4-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)-N-[(3-fluorophenyl)methyl]benzamide CAS Name: 4-(4-amino-1-pyrazolo[3,4-d]pyrimidinyl)-N-[(3-fluorophenyl)methyl]benzamide IUPAC Name: 4-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)-N-[(3-fluorophenyl)methyl]benzamide Traditional Name: 4-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)-N-(3-fluorobenzyl)benzamide Formula: C19H15FN6O MolecularWeight: 362.360403

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)CNC(=O)C2=CC=C(C=C2)N3C4=C(C=N3)C(=NC=N4)N

Isomeric SMILES

C1=CC(=CC(=C1)F)CNC(=O)C2=CC=C(C=C2)N3C4=C(C=N3)C(=NC=N4)N

InChI

InChI=1S/C19H15FN6O/c20-14-3-1-2-12(8-14)9-22-19(27)13-4-6-15(7-5-13)26-18-16(10-25-26)17(21)23-11-24-18/h1-8,10-11H,9H2,(H,22,27)(H2,21,23,24)