5-[2-(2-cyclohexylimino-4-methyl-pyridin-1-yl)-2-oxidanylidene-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[2-(2-cyclohexylimino-4-methyl-pyridin-1-yl)-2-oxidanylidene-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[2-(2-cyclohexylimino-4-methyl-1-pyridyl)-2-oxo-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[2-(2-cyclohexylimino-4-methyl-1-pyridinyl)-2-oxoethyl]-1-methyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[2-(2-cyclohexylimino-4-methylpyridin-1-yl)-2-oxoethyl]-1-methylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[2-(2-cyclohexylimino-4-methyl-1-pyridyl)-2-keto-ethyl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C20H24N6O2 MolecularWeight: 380.44356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2CCCCC2)N(C=C1)C(=O)CN3C=NC4=C(C3=O)C=NN4C

Isomeric SMILES

CC1=CC(=NC2CCCCC2)N(C=C1)C(=O)CN3C=NC4=C(C3=O)C=NN4C

InChI

InChI=1S/C20H24N6O2/c1-14-8-9-26(17(10-14)23-15-6-4-3-5-7-15)18(27)12-25-13-21-19-16(20(25)28)11-22-24(19)2/h8-11,13,15H,3-7,12H2,1-2H3