6-[(3-iodanylphenyl)methylamino]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[(3-iodanylphenyl)methylamino]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-[(3-iodophenyl)methylamino]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-[(3-iodophenyl)methylamino]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-[(3-iodophenyl)methylamino]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-[(3-iodobenzyl)amino]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Formula: C12H10IN5O MolecularWeight: 367.14517

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)I)CNC2=NC(=O)C3=CNNC3=N2

Isomeric SMILES

C1=CC(=CC(=C1)I)CNC2=NC(=O)C3=CNNC3=N2

InChI

InChI=1S/C12H10IN5O/c13-8-3-1-2-7(4-8)5-14-12-16-10-9(6-15-18-10)11(19)17-12/h1-4,6H,5H2,(H3,14,15,16,17,18,19)