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

Systemtic Name: 2-[[2-(4-tert-butylphenyl)carbonyl-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-ethylphenyl)ethanamide Openeye Name: 2-[[2-(4-tert-butylbenzoyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-ethylphenyl)acetamide CAS Name: 2-[[2-[(4-tert-butylphenyl)-oxomethyl]-5-phenyl-1,2,4-triazol-3-yl]thio]-N-(2-ethylphenyl)acetamide IUPAC Name: 2-[[2-(4-tert-butylbenzoyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-ethylphenyl)acetamide Traditional Name: 2-[[2-(4-tert-butylbenzoyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-N-(2-ethylphenyl)acetamide Formula: C29H30N4O2S MolecularWeight: 498.6391

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CSC2=NC(=NN2C(=O)C3=CC=C(C=C3)C(C)(C)C)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CSC2=NC(=NN2C(=O)C3=CC=C(C=C3)C(C)(C)C)C4=CC=CC=C4

InChI

InChI=1S/C29H30N4O2S/c1-5-20-11-9-10-14-24(20)30-25(34)19-36-28-31-26(21-12-7-6-8-13-21)32-33(28)27(35)22-15-17-23(18-16-22)29(2,3)4/h6-18H,5,19H2,1-4H3,(H,30,34)