2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylbutan-2-yl)ethanamide

Systemtic Name: 2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylbutan-2-yl)ethanamide Openeye Name: N-(1,1-dimethylpropyl)-2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-(2-methylbutan-2-yl)acetamide IUPAC Name: 2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylbutan-2-yl)acetamide Traditional Name: N-tert-amyl-2-[[5-(2-methoxyphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=CC=C3OC

Isomeric SMILES

CCC(C)(C)NC(=O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=CC=C3OC

InChI

InChI=1S/C22H26N4O2S/c1-5-22(2,3)23-19(27)15-29-21-25-24-20(17-13-9-10-14-18(17)28-4)26(21)16-11-7-6-8-12-16/h6-14H,5,15H2,1-4H3,(H,23,27)