2-[[4-[2,3-bis(chloranyl)phenyl]-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide

Systemtic Name: 2-[[4-[2,3-bis(chloranyl)phenyl]-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[2,2,2-tris(fluoranyl)ethyl]ethanamide Openeye Name: 2-[[5-(4-tert-butylphenyl)-4-(2,3-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide CAS Name: 2-[[5-(4-tert-butylphenyl)-4-(2,3-dichlorophenyl)-1,2,4-triazol-3-yl]thio]-N-(2,2,2-trifluoroethyl)acetamide IUPAC Name: 2-[[5-(4-tert-butylphenyl)-4-(2,3-dichlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2,2,2-trifluoroethyl)acetamide Traditional Name: 2-[[5-(4-tert-butylphenyl)-4-(2,3-dichlorophenyl)-1,2,4-triazol-3-yl]thio]-N-(2,2,2-trifluoroethyl)acetamide Formula: C22H21Cl2F3N4OS MolecularWeight: 517.39455

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=C(C(=CC=C3)Cl)Cl)SCC(=O)NCC(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=C(C(=CC=C3)Cl)Cl)SCC(=O)NCC(F)(F)F

InChI

InChI=1S/C22H21Cl2F3N4OS/c1-21(2,3)14-9-7-13(8-10-14)19-29-30-20(33-11-17(32)28-12-22(25,26)27)31(19)16-6-4-5-15(23)18(16)24/h4-10H,11-12H2,1-3H3,(H,28,32)