N-cyclopropyl-3-[2-[1-(2-nitrophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]ethanoylamino]benzamide

Systemtic Name: N-cyclopropyl-3-[2-[1-(2-nitrophenyl)-4-oxidanylidene-pyrazolo[3,4-d]pyrimidin-5-yl]ethanoylamino]benzamide Openeye Name: N-cyclopropyl-3-[[2-[1-(2-nitrophenyl)-4-oxo-pyrazolo[3,4-d]pyrimidin-5-yl]acetyl]amino]benzamide CAS Name: N-cyclopropyl-3-[[2-[1-(2-nitrophenyl)-4-oxo-5-pyrazolo[3,4-d]pyrimidinyl]-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclopropyl-3-[[2-[1-(2-nitrophenyl)-4-oxopyrazolo[3,4-d]pyrimidin-5-yl]acetyl]amino]benzamide Traditional Name: N-cyclopropyl-3-[[2-[4-keto-1-(2-nitrophenyl)pyrazolo[3,4-d]pyrimidin-5-yl]acetyl]amino]benzamide Formula: C23H19N7O5 MolecularWeight: 473.44086

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5[N+](=O)[O-]

Isomeric SMILES

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)CN3C=NC4=C(C3=O)C=NN4C5=CC=CC=C5[N+](=O)[O-]

InChI

InChI=1S/C23H19N7O5/c31-20(26-16-5-3-4-14(10-16)22(32)27-15-8-9-15)12-28-13-24-21-17(23(28)33)11-25-29(21)18-6-1-2-7-19(18)30(34)35/h1-7,10-11,13,15H,8-9,12H2,(H,26,31)(H,27,32)