2-[[5-[[2,4-bis(chloranyl)phenoxy]methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-bromanyl-4,5-dimethyl-phenyl)ethanamide

Systemtic Name: 2-[[5-[[2,4-bis(chloranyl)phenoxy]methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-bromanyl-4,5-dimethyl-phenyl)ethanamide Openeye Name: N-(2-bromo-4,5-dimethyl-phenyl)-2-[[5-[(2,4-dichlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-bromo-4,5-dimethylphenyl)-2-[[5-[(2,4-dichlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-bromo-4,5-dimethylphenyl)-2-[[5-[(2,4-dichlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-bromo-4,5-dimethyl-phenyl)-2-[[5-[(2,4-dichlorophenoxy)methyl]-4-methyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H19BrCl2N4O2S MolecularWeight: 530.26546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)Br)NC(=O)CSC2=NN=C(N2C)COC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=CC(=C(C=C1C)Br)NC(=O)CSC2=NN=C(N2C)COC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H19BrCl2N4O2S/c1-11-6-14(21)16(7-12(11)2)24-19(28)10-30-20-26-25-18(27(20)3)9-29-17-5-4-13(22)8-15(17)23/h4-8H,9-10H2,1-3H3,(H,24,28)