1-[5-(4-tert-butylphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-2-phenyl-ethanone

Systemtic Name: 1-[5-(4-tert-butylphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-2-phenyl-ethanone Openeye Name: 1-[5-(4-tert-butylphenyl)-3-isobutoxy-1,2,4-triazol-1-yl]-2-phenyl-ethanone CAS Name: 1-[5-(4-tert-butylphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-2-phenylethanone IUPAC Name: 1-[5-(4-tert-butylphenyl)-3-(2-methylpropoxy)-1,2,4-triazol-1-yl]-2-phenylethanone Traditional Name: 1-[5-(4-tert-butylphenyl)-3-isobutoxy-1,2,4-triazol-1-yl]-2-phenyl-ethanone Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)COC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C24H29N3O2/c1-17(2)16-29-23-25-22(19-11-13-20(14-12-19)24(3,4)5)27(26-23)21(28)15-18-9-7-6-8-10-18/h6-14,17H,15-16H2,1-5H3