N-[5-(3-bromophenyl)-1H-1,2,4-triazol-3-yl]-2-(3,4-dimethylphenoxy)ethanamide

Systemtic Name: N-[5-(3-bromophenyl)-1H-1,2,4-triazol-3-yl]-2-(3,4-dimethylphenoxy)ethanamide Openeye Name: N-[5-(3-bromophenyl)-1H-1,2,4-triazol-3-yl]-2-(3,4-dimethylphenoxy)acetamide CAS Name: N-[5-(3-bromophenyl)-1H-1,2,4-triazol-3-yl]-2-(3,4-dimethylphenoxy)acetamide IUPAC Name: N-[5-(3-bromophenyl)-1H-1,2,4-triazol-3-yl]-2-(3,4-dimethylphenoxy)acetamide Traditional Name: N-[5-(3-bromophenyl)-1H-1,2,4-triazol-3-yl]-2-(3,4-dimethylphenoxy)acetamide Formula: C18H17BrN4O2 MolecularWeight: 401.25718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCC(=O)NC2=NNC(=N2)C3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCC(=O)NC2=NNC(=N2)C3=CC(=CC=C3)Br)C

InChI

InChI=1S/C18H17BrN4O2/c1-11-6-7-15(8-12(11)2)25-10-16(24)20-18-21-17(22-23-18)13-4-3-5-14(19)9-13/h3-9H,10H2,1-2H3,(H2,20,21,22,23,24)