[5-(furan-2-ylmethylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]-(3-nitrophenyl)methanone

Systemtic Name: [5-(furan-2-ylmethylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]-(3-nitrophenyl)methanone Openeye Name: [5-(2-furylmethylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(3-nitrophenyl)methanone CAS Name: [5-(2-furanylmethylamino)-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-(3-nitrophenyl)methanone IUPAC Name: [5-(furan-2-ylmethylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]-(3-nitrophenyl)methanone Traditional Name: [5-(2-furfurylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(3-nitrophenyl)methanone Formula: C19H14N6O4 MolecularWeight: 390.35226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC=CO4

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC=CO4

InChI

InChI=1S/C19H14N6O4/c26-18(13-4-1-6-15(10-13)25(27)28)24-19(21-12-16-7-3-9-29-16)22-17(23-24)14-5-2-8-20-11-14/h1-11H,12H2,(H,21,22,23)