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

Systemtic Name: 3-(4-azanylpyrazolo[3,4-d]pyrimidin-1-yl)-N-methyl-benzamide Openeye Name: 3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)-N-methyl-benzamide CAS Name: 3-(4-amino-1-pyrazolo[3,4-d]pyrimidinyl)-N-methylbenzamide IUPAC Name: 3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)-N-methylbenzamide Traditional Name: 3-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)-N-methyl-benzamide Formula: C13H12N6O MolecularWeight: 268.27398

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)N2C3=C(C=N2)C(=NC=N3)N

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)N2C3=C(C=N2)C(=NC=N3)N

InChI

InChI=1S/C13H12N6O/c1-15-13(20)8-3-2-4-9(5-8)19-12-10(6-18-19)11(14)16-7-17-12/h2-7H,1H3,(H,15,20)(H2,14,16,17)