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

Systemtic Name: N-(2-tert-butylphenyl)-2-[[5-(3-chlorophenyl)-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(2-tert-butylphenyl)-2-[[5-(3-chlorophenyl)-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-tert-butylphenyl)-2-[[5-(3-chlorophenyl)-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-tert-butylphenyl)-2-[[5-(3-chlorophenyl)-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(2-tert-butylphenyl)-2-[[5-(3-chlorophenyl)-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C26H24Cl2N4OS MolecularWeight: 511.46596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1NC(=O)CSC2=NN=C(N2C3=CC=C(C=C3)Cl)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H24Cl2N4OS/c1-26(2,3)21-9-4-5-10-22(21)29-23(33)16-34-25-31-30-24(17-7-6-8-19(28)15-17)32(25)20-13-11-18(27)12-14-20/h4-15H,16H2,1-3H3,(H,29,33)