4-[3-methyl-6-oxidanylidene-1-(7H-purin-6-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzenecarbonitrile

Systemtic Name: 4-[3-methyl-6-oxidanylidene-1-(7H-purin-6-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzenecarbonitrile Openeye Name: 4-[3-methyl-6-oxo-1-(7H-purin-6-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzonitrile CAS Name: 4-[3-methyl-6-oxo-1-(7H-purin-6-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzonitrile IUPAC Name: 4-[3-methyl-6-oxo-1-(7H-purin-6-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzonitrile Traditional Name: 4-[6-keto-3-methyl-1-(7H-purin-6-yl)-4,5-dihydro-2H-pyrazolo[3,4-b]pyridin-4-yl]benzonitrile Formula: C19H14N8O MolecularWeight: 370.36746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(CC(=O)N=C2N(N1)C3=NC=NC4=C3NC=N4)C5=CC=C(C=C5)C#N

Isomeric SMILES

CC1=C2C(CC(=O)N=C2N(N1)C3=NC=NC4=C3NC=N4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C19H14N8O/c1-10-15-13(12-4-2-11(7-20)3-5-12)6-14(28)25-18(15)27(26-10)19-16-17(22-8-21-16)23-9-24-19/h2-5,8-9,13,26H,6H2,1H3,(H,21,22,23,24)