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

Systemtic Name: N-[3-(1H-benzimidazol-2-yl)propyl]-2-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)ethanamide Openeye Name: N-[3-(1H-benzimidazol-2-yl)propyl]-2-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide CAS Name: N-[3-(1H-benzimidazol-2-yl)propyl]-2-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)acetamide IUPAC Name: N-[3-(1H-benzimidazol-2-yl)propyl]-2-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)acetamide Traditional Name: N-[3-(1H-benzimidazol-2-yl)propyl]-2-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide Formula: C18H19N7O2 MolecularWeight: 365.38916

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NCCCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CC(=O)NCCCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C18H19N7O2/c1-24-17-12(9-21-24)18(27)25(11-20-17)10-16(26)19-8-4-7-15-22-13-5-2-3-6-14(13)23-15/h2-3,5-6,9,11H,4,7-8,10H2,1H3,(H,19,26)(H,22,23)