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

Systemtic Name: N-(4-bromanyl-2-ethyl-6-methyl-phenyl)-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-bromo-2-ethyl-6-methyl-phenyl)-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-bromo-2-ethyl-6-methylphenyl)-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-bromo-2-ethyl-6-methylphenyl)-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-bromo-2-ethyl-6-methyl-phenyl)-2-[[4-(4-methoxyphenyl)-5-methyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H23BrN4O2S MolecularWeight: 475.40192

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)Br)C)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCC1=C(C(=CC(=C1)Br)C)NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C21H23BrN4O2S/c1-5-15-11-16(22)10-13(2)20(15)23-19(27)12-29-21-25-24-14(3)26(21)17-6-8-18(28-4)9-7-17/h6-11H,5,12H2,1-4H3,(H,23,27)