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

Systemtic Name: [5-(furan-2-ylmethylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]-(3-methoxyphenyl)methanone Openeye Name: [5-(2-furylmethylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(3-methoxyphenyl)methanone CAS Name: [5-(2-furanylmethylamino)-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-(3-methoxyphenyl)methanone IUPAC Name: [5-(furan-2-ylmethylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]-(3-methoxyphenyl)methanone Traditional Name: [5-(2-furfurylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(3-methoxyphenyl)methanone Formula: C20H17N5O3 MolecularWeight: 375.38068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC=CO4

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2C(=NC(=N2)C3=CN=CC=C3)NCC4=CC=CO4

InChI

InChI=1S/C20H17N5O3/c1-27-16-7-2-5-14(11-16)19(26)25-20(22-13-17-8-4-10-28-17)23-18(24-25)15-6-3-9-21-12-15/h2-12H,13H2,1H3,(H,22,23,24)