2-[[5-(2,4-dichlorophenyl)-4-(2,6-diethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-ethanamide

Systemtic Name: 2-[[5-(2,4-dichlorophenyl)-4-(2,6-diethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-ethanamide Openeye Name: 2-[[5-(2,4-dichlorophenyl)-4-(2,6-diethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propyl-acetamide CAS Name: 2-[[5-(2,4-dichlorophenyl)-4-(2,6-diethylphenyl)-1,2,4-triazol-3-yl]thio]-N-propylacetamide IUPAC Name: 2-[[5-(2,4-dichlorophenyl)-4-(2,6-diethylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propylacetamide Traditional Name: 2-[[5-(2,4-dichlorophenyl)-4-(2,6-diethylphenyl)-1,2,4-triazol-3-yl]thio]-N-propyl-acetamide Formula: C23H26Cl2N4OS MolecularWeight: 477.44974

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC1=NN=C(N1C2=C(C=CC=C2CC)CC)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCCNC(=O)CSC1=NN=C(N1C2=C(C=CC=C2CC)CC)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C23H26Cl2N4OS/c1-4-12-26-20(30)14-31-23-28-27-22(18-11-10-17(24)13-19(18)25)29(23)21-15(5-2)8-7-9-16(21)6-3/h7-11,13H,4-6,12,14H2,1-3H3,(H,26,30)