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

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[[5-ethyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-[[5-ethyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[[5-ethyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[[5-ethyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[[5-ethyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H21BrN4OS MolecularWeight: 445.37594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C2=CC=C(C=C2)C)SCC(=O)NC3=C(C=C(C=C3)C)Br

Isomeric SMILES

CCC1=NN=C(N1C2=CC=C(C=C2)C)SCC(=O)NC3=C(C=C(C=C3)C)Br

InChI

InChI=1S/C20H21BrN4OS/c1-4-18-23-24-20(25(18)15-8-5-13(2)6-9-15)27-12-19(26)22-17-10-7-14(3)11-16(17)21/h5-11H,4,12H2,1-3H3,(H,22,26)