N-[4-[[4-(2-fluoranyl-4-methylsulfonyl-phenyl)-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanamide

Systemtic Name: N-[4-[[4-(2-fluoranyl-4-methylsulfonyl-phenyl)-1,4-diazepan-1-yl]sulfonyl]phenyl]ethanamide Openeye Name: N-[4-[[4-(2-fluoro-4-methylsulfonyl-phenyl)-1,4-diazepan-1-yl]sulfonyl]phenyl]acetamide CAS Name: N-[4-[[4-(2-fluoro-4-methylsulfonylphenyl)-1,4-diazepan-1-yl]sulfonyl]phenyl]acetamide IUPAC Name: N-[4-[[4-(2-fluoro-4-methylsulfonylphenyl)-1,4-diazepan-1-yl]sulfonyl]phenyl]acetamide Traditional Name: N-[4-[[4-(2-fluoro-4-mesyl-phenyl)-1,4-diazepan-1-yl]sulfonyl]phenyl]acetamide Formula: C20H24FN3O5S2 MolecularWeight: 469.550063

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C)F

InChI

InChI=1S/C20H24FN3O5S2/c1-15(25)22-16-4-6-17(7-5-16)31(28,29)24-11-3-10-23(12-13-24)20-9-8-18(14-19(20)21)30(2,26)27/h4-9,14H,3,10-13H2,1-2H3,(H,22,25)