2-[[5-[1-(4-bromanylphenoxy)ethyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[[5-[1-(4-bromanylphenoxy)ethyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[5-[1-(4-bromophenoxy)ethyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[5-[1-(4-bromophenoxy)ethyl]-4-methyl-1,2,4-triazol-3-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[5-[1-(4-bromophenoxy)ethyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[5-[1-(4-bromophenoxy)ethyl]-4-methyl-1,2,4-triazol-3-yl]thio]-N-phenyl-acetamide Formula: C19H19BrN4O2S MolecularWeight: 447.34876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(N1C)SCC(=O)NC2=CC=CC=C2)OC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C1=NN=C(N1C)SCC(=O)NC2=CC=CC=C2)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H19BrN4O2S/c1-13(26-16-10-8-14(20)9-11-16)18-22-23-19(24(18)2)27-12-17(25)21-15-6-4-3-5-7-15/h3-11,13H,12H2,1-2H3,(H,21,25)