N-[1-(4-cyano-3-fluoranyl-phenyl)-1-(3-methylimidazol-4-yl)ethyl]-2-[(3-methoxyphenyl)sulfonylamino]ethanamide

Systemtic Name: N-[1-(4-cyano-3-fluoranyl-phenyl)-1-(3-methylimidazol-4-yl)ethyl]-2-[(3-methoxyphenyl)sulfonylamino]ethanamide Openeye Name: N-[1-(4-cyano-3-fluoro-phenyl)-1-(3-methylimidazol-4-yl)ethyl]-2-[(3-methoxyphenyl)sulfonylamino]acetamide CAS Name: N-[1-(4-cyano-3-fluorophenyl)-1-(3-methyl-4-imidazolyl)ethyl]-2-[(3-methoxyphenyl)sulfonylamino]acetamide IUPAC Name: N-[1-(4-cyano-3-fluorophenyl)-1-(3-methylimidazol-4-yl)ethyl]-2-[(3-methoxyphenyl)sulfonylamino]acetamide Traditional Name: N-[1-(4-cyano-3-fluoro-phenyl)-1-(3-methylimidazol-4-yl)ethyl]-2-[(3-methoxyphenyl)sulfonylamino]acetamide Formula: C22H22FN5O4S MolecularWeight: 471.504583

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)C#N)F)(C2=CN=CN2C)NC(=O)CNS(=O)(=O)C3=CC=CC(=C3)OC

Isomeric SMILES

CC(C1=CC(=C(C=C1)C#N)F)(C2=CN=CN2C)NC(=O)CNS(=O)(=O)C3=CC=CC(=C3)OC

InChI

InChI=1S/C22H22FN5O4S/c1-22(20-12-25-14-28(20)2,16-8-7-15(11-24)19(23)9-16)27-21(29)13-26-33(30,31)18-6-4-5-17(10-18)32-3/h4-10,12,14,26H,13H2,1-3H3,(H,27,29)