N-(5-acetamido-2-fluoranyl-phenyl)-2-[furan-2-ylmethyl-(4-methylphenyl)sulfonyl-amino]ethanamide

Systemtic Name: N-(5-acetamido-2-fluoranyl-phenyl)-2-[furan-2-ylmethyl-(4-methylphenyl)sulfonyl-amino]ethanamide Openeye Name: N-(5-acetamido-2-fluoro-phenyl)-2-[2-furylmethyl(p-tolylsulfonyl)amino]acetamide CAS Name: N-(5-acetamido-2-fluorophenyl)-2-[2-furanylmethyl-(4-methylphenyl)sulfonylamino]acetamide IUPAC Name: N-(5-acetamido-2-fluorophenyl)-2-[furan-2-ylmethyl-(4-methylphenyl)sulfonylamino]acetamide Traditional Name: N-(5-acetamido-2-fluoro-phenyl)-2-[2-furfuryl(tosyl)amino]acetamide Formula: C22H22FN3O5S MolecularWeight: 459.490583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC(=O)NC3=C(C=CC(=C3)NC(=O)C)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CO2)CC(=O)NC3=C(C=CC(=C3)NC(=O)C)F

InChI

InChI=1S/C22H22FN3O5S/c1-15-5-8-19(9-6-15)32(29,30)26(13-18-4-3-11-31-18)14-22(28)25-21-12-17(24-16(2)27)7-10-20(21)23/h3-12H,13-14H2,1-2H3,(H,24,27)(H,25,28)