N-(1H-benzimidazol-2-ylmethyl)-2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)acetamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)acetamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide Formula: C16H15N7O2 MolecularWeight: 337.336

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C16H15N7O2/c1-22-15-10(6-19-22)16(25)23(9-18-15)8-14(24)17-7-13-20-11-4-2-3-5-12(11)21-13/h2-6,9H,7-8H2,1H3,(H,17,24)(H,20,21)