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

Systemtic Name: N-aminocarbonyl-2-[[4-azanyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-carbamoyl-propanamide CAS Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]-N-carbamoylpropanamide IUPAC Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-carbamoylpropanamide Traditional Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]-N-carbamoyl-propionamide Formula: C7H9F3N6O2S MolecularWeight: 298.24557

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H9F3N6O2S/c1-2(3(17)13-5(11)18)19-6-15-14-4(16(6)12)7(8,9)10/h2H,12H2,1H3,(H3,11,13,17,18)