2-[(4-azanyl-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-chloranyl-4-fluoranyl-phenyl)ethanamide

Systemtic Name: 2-[(4-azanyl-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-chloranyl-4-fluoranyl-phenyl)ethanamide Openeye Name: 2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-chloro-4-fluoro-phenyl)acetamide CAS Name: 2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]-N-(2-chloro-4-fluorophenyl)acetamide IUPAC Name: 2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-chloro-4-fluorophenyl)acetamide Traditional Name: 2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]-N-(2-chloro-4-fluoro-phenyl)acetamide Formula: C14H17ClFN5OS MolecularWeight: 357.834083

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN=C(N1N)SCC(=O)NC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

CC(C)(C)C1=NN=C(N1N)SCC(=O)NC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C14H17ClFN5OS/c1-14(2,3)12-19-20-13(21(12)17)23-7-11(22)18-10-5-4-8(16)6-9(10)15/h4-6H,7,17H2,1-3H3,(H,18,22)