1-[3-(furan-2-yl)-5-[(phenylmethyl)amino]-1,2,4-triazol-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[3-(furan-2-yl)-5-[(phenylmethyl)amino]-1,2,4-triazol-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[5-(benzylamino)-3-(2-furyl)-1,2,4-triazol-1-yl]-2-methyl-propan-1-one CAS Name: 1-[3-(2-furanyl)-5-[(phenylmethyl)amino]-1,2,4-triazol-1-yl]-2-methyl-1-propanone IUPAC Name: 1-[5-(benzylamino)-3-(furan-2-yl)-1,2,4-triazol-1-yl]-2-methylpropan-1-one Traditional Name: 1-[5-(benzylamino)-3-(2-furyl)-1,2,4-triazol-1-yl]-2-methyl-propan-1-one Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1C(=NC(=N1)C2=CC=CO2)NCC3=CC=CC=C3

Isomeric SMILES

CC(C)C(=O)N1C(=NC(=N1)C2=CC=CO2)NCC3=CC=CC=C3

InChI

InChI=1S/C17H18N4O2/c1-12(2)16(22)21-17(18-11-13-7-4-3-5-8-13)19-15(20-21)14-9-6-10-23-14/h3-10,12H,11H2,1-2H3,(H,18,19,20)