3-(5-isocyanopyridin-2-yl)-5-(3-methoxy-5-pyridin-3-yl-phenyl)-1,2,4-oxadiazole

Systemtic Name: 3-(5-isocyanopyridin-2-yl)-5-(3-methoxy-5-pyridin-3-yl-phenyl)-1,2,4-oxadiazole Openeye Name: 3-(5-isocyano-2-pyridyl)-5-[3-methoxy-5-(3-pyridyl)phenyl]-1,2,4-oxadiazole CAS Name: 3-(5-isocyano-2-pyridinyl)-5-[3-methoxy-5-(3-pyridinyl)phenyl]-1,2,4-oxadiazole IUPAC Name: 3-(5-isocyanopyridin-2-yl)-5-(3-methoxy-5-pyridin-3-ylphenyl)-1,2,4-oxadiazole Traditional Name: 3-(5-isocyano-2-pyridyl)-5-[3-methoxy-5-(3-pyridyl)phenyl]-1,2,4-oxadiazole Formula: C20H13N5O2 MolecularWeight: 355.34952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C2=NC(=NO2)C3=NC=C(C=C3)[N+]#[C-])C4=CN=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1)C2=NC(=NO2)C3=NC=C(C=C3)[N+]#[C-])C4=CN=CC=C4

InChI

InChI=1S/C20H13N5O2/c1-21-16-5-6-18(23-12-16)19-24-20(27-25-19)15-8-14(9-17(10-15)26-2)13-4-3-7-22-11-13/h3-12H,2H3