N-[2-(4-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]ethanamide

Systemtic Name: N-[2-(4-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]ethanamide Openeye Name: N-[2-(4-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]acetamide CAS Name: N-[2-(4-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]acetamide IUPAC Name: N-[2-(4-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]acetamide Traditional Name: N-[2-(4-fluorophenyl)sulfonyl-5-(4-methyl-1,4-diazepan-1-yl)phenyl]acetamide Formula: C20H24FN3O3S MolecularWeight: 405.486263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H24FN3O3S/c1-15(25)22-19-14-17(24-11-3-10-23(2)12-13-24)6-9-20(19)28(26,27)18-7-4-16(21)5-8-18/h4-9,14H,3,10-13H2,1-2H3,(H,22,25)