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

Systemtic Name: 1-[5-(furan-2-ylmethylamino)-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-2-methoxy-ethanone Openeye Name: 1-[5-(2-furylmethylamino)-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-2-methoxy-ethanone CAS Name: 1-[5-(2-furanylmethylamino)-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-2-methoxyethanone IUPAC Name: 1-[5-(furan-2-ylmethylamino)-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-2-methoxyethanone Traditional Name: 1-[5-(2-furfurylamino)-3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]-2-methoxy-ethanone Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1C(=NC(=N1)C2=CC=C(C=C2)OC)NCC3=CC=CO3

Isomeric SMILES

COCC(=O)N1C(=NC(=N1)C2=CC=C(C=C2)OC)NCC3=CC=CO3

InChI

InChI=1S/C17H18N4O4/c1-23-11-15(22)21-17(18-10-14-4-3-9-25-14)19-16(20-21)12-5-7-13(24-2)8-6-12/h3-9H,10-11H2,1-2H3,(H,18,19,20)