2-[[4-azanyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propan-2-yl-propanamide

Systemtic Name: 2-[[4-azanyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propan-2-yl-propanamide Openeye Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-isopropyl-propanamide CAS Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]-N-propan-2-ylpropanamide IUPAC Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-propan-2-ylpropanamide Traditional Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]-N-isopropyl-propionamide Formula: C9H14F3N5OS MolecularWeight: 297.30057

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(C)SC1=NN=C(N1N)C(F)(F)F

Isomeric SMILES

CC(C)NC(=O)C(C)SC1=NN=C(N1N)C(F)(F)F

InChI

InChI=1S/C9H14F3N5OS/c1-4(2)14-6(18)5(3)19-8-16-15-7(17(8)13)9(10,11)12/h4-5H,13H2,1-3H3,(H,14,18)