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

Systemtic Name: N-(4-bromanyl-2-ethyl-6-methyl-phenyl)-2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-bromo-2-ethyl-6-methyl-phenyl)-2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-bromo-2-ethyl-6-methylphenyl)-2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-bromo-2-ethyl-6-methylphenyl)-2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-bromo-2-ethyl-6-methyl-phenyl)-2-[[4-(2-methoxyethyl)-5-phenyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H25BrN4O2S MolecularWeight: 489.4285

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)Br)C)NC(=O)CSC2=NN=C(N2CCOC)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(C(=CC(=C1)Br)C)NC(=O)CSC2=NN=C(N2CCOC)C3=CC=CC=C3

InChI

InChI=1S/C22H25BrN4O2S/c1-4-16-13-18(23)12-15(2)20(16)24-19(28)14-30-22-26-25-21(27(22)10-11-29-3)17-8-6-5-7-9-17/h5-9,12-13H,4,10-11,14H2,1-3H3,(H,24,28)