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

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-2-[[5-(4-tert-butylphenyl)-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(4-tert-butylphenyl)-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3,4-difluorophenyl)acetamide CAS Name: 2-[[5-(4-tert-butylphenyl)-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-(3,4-difluorophenyl)acetamide IUPAC Name: 2-[[5-(4-tert-butylphenyl)-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3,4-difluorophenyl)acetamide Traditional Name: 2-[[5-(4-tert-butylphenyl)-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-(3,4-difluorophenyl)acetamide Formula: C26H23ClF2N4OS MolecularWeight: 513.001826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NC4=CC(=C(C=C4)F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NC4=CC(=C(C=C4)F)F

InChI

InChI=1S/C26H23ClF2N4OS/c1-26(2,3)17-6-4-16(5-7-17)24-31-32-25(33(24)20-11-8-18(27)9-12-20)35-15-23(34)30-19-10-13-21(28)22(29)14-19/h4-14H,15H2,1-3H3,(H,30,34)