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

Systemtic Name: N-[3-(4-azanylpyrazolo[3,4-d]pyrimidin-1-yl)phenyl]benzamide Openeye Name: N-[3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]benzamide CAS Name: N-[3-(4-amino-1-pyrazolo[3,4-d]pyrimidinyl)phenyl]benzamide IUPAC Name: N-[3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]benzamide Traditional Name: N-[3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)phenyl]benzamide Formula: C18H14N6O MolecularWeight: 330.34336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)N3C4=C(C=N3)C(=NC=N4)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)N3C4=C(C=N3)C(=NC=N4)N

InChI

InChI=1S/C18H14N6O/c19-16-15-10-22-24(17(15)21-11-20-16)14-8-4-7-13(9-14)23-18(25)12-5-2-1-3-6-12/h1-11H,(H,23,25)(H2,19,20,21)