2-[(4-azanyl-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-fluorophenyl)carbamoyl]ethanamide

Systemtic Name: 2-[(4-azanyl-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-fluorophenyl)carbamoyl]ethanamide Openeye Name: 2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-fluorophenyl)carbamoyl]acetamide CAS Name: 2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]-N-[(2-fluoroanilino)-oxomethyl]acetamide IUPAC Name: 2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2-fluorophenyl)carbamoyl]acetamide Traditional Name: 2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]-N-[(2-fluorophenyl)carbamoyl]acetamide Formula: C15H19FN6O2S MolecularWeight: 366.413763

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN=C(N1N)SCC(=O)NC(=O)NC2=CC=CC=C2F

Isomeric SMILES

CC(C)(C)C1=NN=C(N1N)SCC(=O)NC(=O)NC2=CC=CC=C2F

InChI

InChI=1S/C15H19FN6O2S/c1-15(2,3)12-20-21-14(22(12)17)25-8-11(23)19-13(24)18-10-7-5-4-6-9(10)16/h4-7H,8,17H2,1-3H3,(H2,18,19,23,24)