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

Systemtic Name: 2-[[4-azanyl-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylbutan-2-yl)ethanamide Openeye Name: 2-[[4-amino-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1,1-dimethylpropyl)acetamide CAS Name: 2-[[4-amino-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-(2-methylbutan-2-yl)acetamide IUPAC Name: 2-[[4-amino-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylbutan-2-yl)acetamide Traditional Name: 2-[[4-amino-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]-N-tert-amyl-acetamide Formula: C16H23N5OS MolecularWeight: 333.45172

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)CSC1=NN=C(N1N)C2=CC=C(C=C2)C

Isomeric SMILES

CCC(C)(C)NC(=O)CSC1=NN=C(N1N)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H23N5OS/c1-5-16(3,4)18-13(22)10-23-15-20-19-14(21(15)17)12-8-6-11(2)7-9-12/h6-9H,5,10,17H2,1-4H3,(H,18,22)