N-[[4-[2,5-bis(chloranyl)phenyl]-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-2-methoxy-ethanamide

Systemtic Name: N-[[4-[2,5-bis(chloranyl)phenyl]-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-2-methoxy-ethanamide Openeye Name: N-[[4-(2,5-dichlorophenyl)-5-(m-tolylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-2-methoxy-acetamide CAS Name: N-[[4-(2,5-dichlorophenyl)-5-[(3-methylphenyl)methylthio]-1,2,4-triazol-3-yl]methyl]-2-methoxyacetamide IUPAC Name: N-[[4-(2,5-dichlorophenyl)-5-[(3-methylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]-2-methoxyacetamide Traditional Name: N-[[4-(2,5-dichlorophenyl)-5-[(3-methylbenzyl)thio]-1,2,4-triazol-3-yl]methyl]-2-methoxy-acetamide Formula: C20H20Cl2N4O2S MolecularWeight: 451.3694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC2=NN=C(N2C3=C(C=CC(=C3)Cl)Cl)CNC(=O)COC

Isomeric SMILES

CC1=CC(=CC=C1)CSC2=NN=C(N2C3=C(C=CC(=C3)Cl)Cl)CNC(=O)COC

InChI

InChI=1S/C20H20Cl2N4O2S/c1-13-4-3-5-14(8-13)12-29-20-25-24-18(10-23-19(27)11-28-2)26(20)17-9-15(21)6-7-16(17)22/h3-9H,10-12H2,1-2H3,(H,23,27)