2-[1-(4-methoxyphenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]-N-(4-pyrrolidin-1-ylphenyl)ethanamide

Systemtic Name: 2-[1-(4-methoxyphenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-[1-(4-methoxyphenyl)-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl]-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-[1-(4-methoxyphenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-[1-(4-methoxyphenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[4-keto-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-5-yl]-N-(4-pyrrolidinophenyl)acetamide Formula: C24H24N6O3 MolecularWeight: 444.48576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)CC(=O)NC4=CC=C(C=C4)N5CCCC5

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=C(C=N2)C(=O)N(C=N3)CC(=O)NC4=CC=C(C=C4)N5CCCC5

InChI

InChI=1S/C24H24N6O3/c1-33-20-10-8-19(9-11-20)30-23-21(14-26-30)24(32)29(16-25-23)15-22(31)27-17-4-6-18(7-5-17)28-12-2-3-13-28/h4-11,14,16H,2-3,12-13,15H2,1H3,(H,27,31)