1-[3-(furan-2-yl)-5-[(4-phenylmethoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-3-methyl-butan-1-one

Systemtic Name: 1-[3-(furan-2-yl)-5-[(4-phenylmethoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-3-methyl-butan-1-one Openeye Name: 1-[5-[(4-benzyloxyphenyl)methylamino]-3-(2-furyl)-1,2,4-triazol-1-yl]-3-methyl-butan-1-one CAS Name: 1-[3-(2-furanyl)-5-[(4-phenylmethoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-3-methyl-1-butanone IUPAC Name: 1-[3-(furan-2-yl)-5-[(4-phenylmethoxyphenyl)methylamino]-1,2,4-triazol-1-yl]-3-methylbutan-1-one Traditional Name: 1-[5-[(4-benzoxybenzyl)amino]-3-(2-furyl)-1,2,4-triazol-1-yl]-3-methyl-butan-1-one Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)N1C(=NC(=N1)C2=CC=CO2)NCC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)CC(=O)N1C(=NC(=N1)C2=CC=CO2)NCC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H26N4O3/c1-18(2)15-23(30)29-25(27-24(28-29)22-9-6-14-31-22)26-16-19-10-12-21(13-11-19)32-17-20-7-4-3-5-8-20/h3-14,18H,15-17H2,1-2H3,(H,26,27,28)