[5-(4-tert-butylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-(3-fluorophenyl)methanone

Systemtic Name: [5-(4-tert-butylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-(3-fluorophenyl)methanone Openeye Name: [5-(4-tert-butylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-(3-fluorophenyl)methanone CAS Name: [5-(4-tert-butylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-(3-fluorophenyl)methanone IUPAC Name: [5-(4-tert-butylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-(3-fluorophenyl)methanone Traditional Name: [5-(4-tert-butylphenyl)-3-propoxy-1,2,4-triazol-1-yl]-(3-fluorophenyl)methanone Formula: C22H24FN3O2 MolecularWeight: 381.443263

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCCOC1=NN(C(=N1)C2=CC=C(C=C2)C(C)(C)C)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H24FN3O2/c1-5-13-28-21-24-19(15-9-11-17(12-10-15)22(2,3)4)26(25-21)20(27)16-7-6-8-18(23)14-16/h6-12,14H,5,13H2,1-4H3