1-[4-(4-azanyl-3-iodanyl-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl]-2-(dimethylamino)ethanone

Systemtic Name: 1-[4-(4-azanyl-3-iodanyl-pyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl]-2-(dimethylamino)ethanone Openeye Name: 1-[4-(4-amino-3-iodo-pyrazolo[3,4-d]pyrimidin-1-yl)-1-piperidyl]-2-(dimethylamino)ethanone CAS Name: 1-[4-(4-amino-3-iodo-1-pyrazolo[3,4-d]pyrimidinyl)-1-piperidinyl]-2-(dimethylamino)ethanone IUPAC Name: 1-[4-(4-amino-3-iodopyrazolo[3,4-d]pyrimidin-1-yl)piperidin-1-yl]-2-(dimethylamino)ethanone Traditional Name: 1-[4-(4-amino-3-iodo-pyrazolo[3,4-d]pyrimidin-1-yl)piperidino]-2-(dimethylamino)ethanone Formula: C14H20IN7O MolecularWeight: 429.25937

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(=O)N1CCC(CC1)N2C3=C(C(=NC=N3)N)C(=N2)I

Isomeric SMILES

CN(C)CC(=O)N1CCC(CC1)N2C3=C(C(=NC=N3)N)C(=N2)I

InChI

InChI=1S/C14H20IN7O/c1-20(2)7-10(23)21-5-3-9(4-6-21)22-14-11(12(15)19-22)13(16)17-8-18-14/h8-9H,3-7H2,1-2H3,(H2,16,17,18)