(2-bromophenyl)-[3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]methanone

Systemtic Name: (2-bromophenyl)-[3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]methanone Openeye Name: (2-bromophenyl)-[3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]methanone CAS Name: (2-bromophenyl)-[3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]methanone IUPAC Name: (2-bromophenyl)-[3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]methanone Traditional Name: (2-bromophenyl)-[3-butoxy-5-(4-ethylphenyl)-1,2,4-triazol-1-yl]methanone Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)CC)C(=O)C3=CC=CC=C3Br

Isomeric SMILES

CCCCOC1=NN(C(=N1)C2=CC=C(C=C2)CC)C(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C21H22BrN3O2/c1-3-5-14-27-21-23-19(16-12-10-15(4-2)11-13-16)25(24-21)20(26)17-8-6-7-9-18(17)22/h6-13H,3-5,14H2,1-2H3