N-[5-[5-chloranyl-6-(methoxyamino)pyrimidin-4-yl]-2-cyano-4-fluoranyl-phenyl]ethanesulfonamide

Systemtic Name: N-[5-[5-chloranyl-6-(methoxyamino)pyrimidin-4-yl]-2-cyano-4-fluoranyl-phenyl]ethanesulfonamide Openeye Name: N-[5-[5-chloro-6-(methoxyamino)pyrimidin-4-yl]-2-cyano-4-fluoro-phenyl]ethanesulfonamide CAS Name: N-[5-[5-chloro-6-(methoxyamino)-4-pyrimidinyl]-2-cyano-4-fluorophenyl]ethanesulfonamide IUPAC Name: N-[5-[5-chloro-6-(methoxyamino)pyrimidin-4-yl]-2-cyano-4-fluorophenyl]ethanesulfonamide Traditional Name: N-[5-[5-chloro-6-(methoxyamino)pyrimidin-4-yl]-2-cyano-4-fluoro-phenyl]ethanesulfonamide Formula: C14H13ClFN5O3S MolecularWeight: 385.801123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=CC(=C(C=C1C#N)F)C2=C(C(=NC=N2)NOC)Cl

Isomeric SMILES

CCS(=O)(=O)NC1=CC(=C(C=C1C#N)F)C2=C(C(=NC=N2)NOC)Cl

InChI

InChI=1S/C14H13ClFN5O3S/c1-3-25(22,23)21-11-5-9(10(16)4-8(11)6-17)13-12(15)14(20-24-2)19-7-18-13/h4-5,7,21H,3H2,1-2H3,(H,18,19,20)