N-[[4-(diethylsulfamoyl)phenyl]methyl]-3-fluoranyl-4-(4-methylpiperazin-1-yl)benzamide

Systemtic Name: N-[[4-(diethylsulfamoyl)phenyl]methyl]-3-fluoranyl-4-(4-methylpiperazin-1-yl)benzamide Openeye Name: N-[[4-(diethylsulfamoyl)phenyl]methyl]-3-fluoro-4-(4-methylpiperazin-1-yl)benzamide CAS Name: N-[[4-(diethylsulfamoyl)phenyl]methyl]-3-fluoro-4-(4-methyl-1-piperazinyl)benzamide IUPAC Name: N-[[4-(diethylsulfamoyl)phenyl]methyl]-3-fluoro-4-(4-methylpiperazin-1-yl)benzamide Traditional Name: N-[4-(diethylsulfamoyl)benzyl]-3-fluoro-4-(4-methylpiperazino)benzamide Formula: C23H31FN4O3S MolecularWeight: 462.580643

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C)F

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C)F

InChI

InChI=1S/C23H31FN4O3S/c1-4-28(5-2)32(30,31)20-9-6-18(7-10-20)17-25-23(29)19-8-11-22(21(24)16-19)27-14-12-26(3)13-15-27/h6-11,16H,4-5,12-15,17H2,1-3H3,(H,25,29)