3-[4-cyano-2,5-bis(fluoranyl)phenyl]sulfonyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide

Systemtic Name: 3-[4-cyano-2,5-bis(fluoranyl)phenyl]sulfonyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide Openeye Name: 3-(4-cyano-2,5-difluoro-phenyl)sulfonyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide CAS Name: 3-(4-cyano-2,5-difluorophenyl)sulfonyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide IUPAC Name: 3-(4-cyano-2,5-difluorophenyl)sulfonyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide Traditional Name: 3-(4-cyano-2,5-difluoro-phenyl)sulfonyl-N,N-dimethyl-1,2,4-triazole-1-carboxamide Formula: C12H9F2N5O3S MolecularWeight: 341.293366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N1C=NC(=N1)S(=O)(=O)C2=C(C=C(C(=C2)F)C#N)F

Isomeric SMILES

CN(C)C(=O)N1C=NC(=N1)S(=O)(=O)C2=C(C=C(C(=C2)F)C#N)F

InChI

InChI=1S/C12H9F2N5O3S/c1-18(2)12(20)19-6-16-11(17-19)23(21,22)10-4-8(13)7(5-15)3-9(10)14/h3-4,6H,1-2H3