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

Systemtic Name: N-(2-methylbutan-2-yl)-2-[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(1,1-dimethylpropyl)-2-[[4-(p-tolyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-methylbutan-2-yl)-2-[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-methylbutan-2-yl)-2-[[4-(4-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-tert-amyl-2-[[4-(p-tolyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N5OS/c1-5-21(3,4)23-18(27)14-28-20-25-24-19(16-10-12-22-13-11-16)26(20)17-8-6-15(2)7-9-17/h6-13H,5,14H2,1-4H3,(H,23,27)