6-(3H-benzimidazol-5-yl)-1-cyclopentyl-3-ethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-(3H-benzimidazol-5-yl)-1-cyclopentyl-3-ethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(3H-benzimidazol-5-yl)-1-cyclopentyl-3-ethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(3H-benzimidazol-5-yl)-1-cyclopentyl-3-ethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-(3H-benzimidazol-5-yl)-1-cyclopentyl-3-ethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(3H-benzimidazol-5-yl)-1-cyclopentyl-3-ethyl-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C19H20N6O MolecularWeight: 348.4017

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=NC(=NC2=O)C3=CC4=C(C=C3)N=CN4)N(N1)C5CCCC5

Isomeric SMILES

CCC1=C2C(=NC(=NC2=O)C3=CC4=C(C=C3)N=CN4)N(N1)C5CCCC5

InChI

InChI=1S/C19H20N6O/c1-2-13-16-18(25(24-13)12-5-3-4-6-12)22-17(23-19(16)26)11-7-8-14-15(9-11)21-10-20-14/h7-10,12,24H,2-6H2,1H3,(H,20,21)