N-[1-benzofuran-2-yl(phenyl)methyl]-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide

Systemtic Name: N-[1-benzofuran-2-yl(phenyl)methyl]-3-(1-methyl-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide Openeye Name: N-[benzofuran-2-yl(phenyl)methyl]-3-(1-methyl-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl)propanamide CAS Name: N-[2-benzofuranyl(phenyl)methyl]-3-(1-methyl-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl)propanamide IUPAC Name: N-[1-benzofuran-2-yl(phenyl)methyl]-3-(1-methyl-4-oxopyrazolo[3,4-d]pyrimidin-5-yl)propanamide Traditional Name: N-[benzofuran-2-yl(phenyl)methyl]-3-(4-keto-1-methyl-pyrazolo[3,4-d]pyrimidin-5-yl)propionamide Formula: C24H21N5O3 MolecularWeight: 427.45524

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)NC(C3=CC=CC=C3)C4=CC5=CC=CC=C5O4

Isomeric SMILES

CN1C2=C(C=N1)C(=O)N(C=N2)CCC(=O)NC(C3=CC=CC=C3)C4=CC5=CC=CC=C5O4

InChI

InChI=1S/C24H21N5O3/c1-28-23-18(14-26-28)24(31)29(15-25-23)12-11-21(30)27-22(16-7-3-2-4-8-16)20-13-17-9-5-6-10-19(17)32-20/h2-10,13-15,22H,11-12H2,1H3,(H,27,30)