N-methyl-2-[1-(2-nitrophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]-N-(1-phenylethyl)ethanamide

Systemtic Name: N-methyl-2-[1-(2-nitrophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]-N-(1-phenylethyl)ethanamide Openeye Name: N-methyl-2-[1-(2-nitrophenyl)-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl]-N-(1-phenylethyl)acetamide CAS Name: N-methyl-2-[1-(2-nitrophenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]-N-(1-phenylethyl)acetamide IUPAC Name: N-methyl-2-[1-(2-nitrophenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]-N-(1-phenylethyl)acetamide Traditional Name: 2-[4-keto-1-(2-nitrophenyl)pyrazolo[3,4-d]pyrimidin-5-yl]-N-methyl-N-(1-phenylethyl)acetamide Formula: C22H20N6O4 MolecularWeight: 432.432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(C)C(=O)CN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1)N(C)C(=O)CN2C=NC3=C(C2=O)C=NN3C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C22H20N6O4/c1-15(16-8-4-3-5-9-16)25(2)20(29)13-26-14-23-21-17(22(26)30)12-24-27(21)18-10-6-7-11-19(18)28(31)32/h3-12,14-15H,13H2,1-2H3