N-[7-iodanyl-5-(3-nitrophenyl)-3-phenethyl-2,7-dihydropyrazolo[4,3-d]pyrimidin-6-yl]pyridine-3-carboxamide

Systemtic Name: N-[7-iodanyl-5-(3-nitrophenyl)-3-phenethyl-2,7-dihydropyrazolo[4,3-d]pyrimidin-6-yl]pyridine-3-carboxamide Openeye Name: N-[7-iodo-5-(3-nitrophenyl)-3-phenethyl-2,7-dihydropyrazolo[4,3-d]pyrimidin-6-yl]pyridine-3-carboxamide CAS Name: N-[7-iodo-5-(3-nitrophenyl)-3-phenethyl-2,7-dihydropyrazolo[4,3-d]pyrimidin-6-yl]-3-pyridinecarboxamide IUPAC Name: N-[7-iodo-5-(3-nitrophenyl)-3-phenethyl-2,7-dihydropyrazolo[4,3-d]pyrimidin-6-yl]pyridine-3-carboxamide Traditional Name: N-[7-iodo-5-(3-nitrophenyl)-3-phenethyl-2,7-dihydropyrazolo[4,3-d]pyrimidin-6-yl]nicotinamide Formula: C25H20IN7O3 MolecularWeight: 593.37587

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=C3C(=NN2)C(N(C(=N3)C4=CC(=CC=C4)[N+](=O)[O-])NC(=O)C5=CN=CC=C5)I

Isomeric SMILES

C1=CC=C(C=C1)CCC2=C3C(=NN2)C(N(C(=N3)C4=CC(=CC=C4)[N+](=O)[O-])NC(=O)C5=CN=CC=C5)I

InChI

InChI=1S/C25H20IN7O3/c26-23-22-21(20(29-30-22)12-11-16-6-2-1-3-7-16)28-24(17-8-4-10-19(14-17)33(35)36)32(23)31-25(34)18-9-5-13-27-15-18/h1-10,13-15,23H,11-12H2,(H,29,30)(H,31,34)