N-[2-cyano-5-(3,4-dimethyl-5-oxidanylidene-1,2,4-triazol-1-yl)-4-fluoranyl-phenyl]-N-ethylsulfonyl-ethanamide

Systemtic Name: N-[2-cyano-5-(3,4-dimethyl-5-oxidanylidene-1,2,4-triazol-1-yl)-4-fluoranyl-phenyl]-N-ethylsulfonyl-ethanamide Openeye Name: N-[2-cyano-5-(3,4-dimethyl-5-oxo-1,2,4-triazol-1-yl)-4-fluoro-phenyl]-N-ethylsulfonyl-acetamide CAS Name: N-[2-cyano-5-(3,4-dimethyl-5-oxo-1,2,4-triazol-1-yl)-4-fluorophenyl]-N-ethylsulfonylacetamide IUPAC Name: N-[2-cyano-5-(3,4-dimethyl-5-oxo-1,2,4-triazol-1-yl)-4-fluorophenyl]-N-ethylsulfonylacetamide Traditional Name: N-[2-cyano-4-fluoro-5-(5-keto-3,4-dimethyl-1,2,4-triazol-1-yl)phenyl]-N-esyl-acetamide Formula: C15H16FN5O4S MolecularWeight: 381.382043

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N(C1=CC(=C(C=C1C#N)F)N2C(=O)N(C(=N2)C)C)C(=O)C

Isomeric SMILES

CCS(=O)(=O)N(C1=CC(=C(C=C1C#N)F)N2C(=O)N(C(=N2)C)C)C(=O)C

InChI

InChI=1S/C15H16FN5O4S/c1-5-26(24,25)21(10(3)22)13-7-14(12(16)6-11(13)8-17)20-15(23)19(4)9(2)18-20/h6-7H,5H2,1-4H3