N-tert-butyl-2-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-tert-butyl-2-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-tert-butyl-2-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-tert-butyl-2-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-tert-butyl-2-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-tert-butyl-2-[[5-(2-fluorophenyl)-4-methyl-1,2,4-triazol-3-yl]thio]propionamide Formula: C16H21FN4OS MolecularWeight: 336.427543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)SC1=NN=C(N1C)C2=CC=CC=C2F

Isomeric SMILES

CC(C(=O)NC(C)(C)C)SC1=NN=C(N1C)C2=CC=CC=C2F

InChI

InChI=1S/C16H21FN4OS/c1-10(14(22)18-16(2,3)4)23-15-20-19-13(21(15)5)11-8-6-7-9-12(11)17/h6-10H,1-5H3,(H,18,22)