4-fluoranyl-N-[5-(2-phenylazanylpyrimidin-4-yl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]benzamide

Systemtic Name: 4-fluoranyl-N-[5-(2-phenylazanylpyrimidin-4-yl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]benzamide Openeye Name: N-[5-(2-anilinopyrimidin-4-yl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-4-fluoro-benzamide CAS Name: N-[5-(2-anilino-4-pyrimidinyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-4-fluorobenzamide IUPAC Name: N-[5-(2-anilinopyrimidin-4-yl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-4-fluorobenzamide Traditional Name: N-[5-(2-anilinopyrimidin-4-yl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-4-fluoro-benzamide Formula: C22H18FN7O MolecularWeight: 415.423023

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(CN1C3=NC(=NC=C3)NC4=CC=CC=C4)NN=C2NC(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1C2=C(CN1C3=NC(=NC=C3)NC4=CC=CC=C4)NN=C2NC(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C22H18FN7O/c23-15-8-6-14(7-9-15)21(31)27-20-17-12-30(13-18(17)28-29-20)19-10-11-24-22(26-19)25-16-4-2-1-3-5-16/h1-11H,12-13H2,(H,24,25,26)(H2,27,28,29,31)