N-(4-bromanyl-2-ethyl-6-methyl-phenyl)-2-[[4-(4-ethylphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-bromanyl-2-ethyl-6-methyl-phenyl)-2-[[4-(4-ethylphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-bromo-2-ethyl-6-methyl-phenyl)-2-[[4-(4-ethylphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-bromo-2-ethyl-6-methylphenyl)-2-[[4-(4-ethylphenyl)-5-methyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-bromo-2-ethyl-6-methylphenyl)-2-[[4-(4-ethylphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-bromo-2-ethyl-6-methyl-phenyl)-2-[[4-(4-ethylphenyl)-5-methyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H25BrN4OS MolecularWeight: 473.4291

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3C)Br)CC)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C(C=C3C)Br)CC)C

InChI

InChI=1S/C22H25BrN4OS/c1-5-16-7-9-19(10-8-16)27-15(4)25-26-22(27)29-13-20(28)24-21-14(3)11-18(23)12-17(21)6-2/h7-12H,5-6,13H2,1-4H3,(H,24,28)