N-[4-[4-(2-azanylethyl)-3-fluoranyl-phenyl]phenyl]-N-(2-oxidanylpropyl)propane-2-sulfonamide

Systemtic Name: N-[4-[4-(2-azanylethyl)-3-fluoranyl-phenyl]phenyl]-N-(2-oxidanylpropyl)propane-2-sulfonamide Openeye Name: N-[4-[4-(2-aminoethyl)-3-fluoro-phenyl]phenyl]-N-(2-hydroxypropyl)propane-2-sulfonamide CAS Name: N-[4-[4-(2-aminoethyl)-3-fluorophenyl]phenyl]-N-(2-hydroxypropyl)-2-propanesulfonamide IUPAC Name: N-[4-[4-(2-aminoethyl)-3-fluorophenyl]phenyl]-N-(2-hydroxypropyl)propane-2-sulfonamide Traditional Name: N-[4-[4-(2-aminoethyl)-3-fluoro-phenyl]phenyl]-N-(2-hydroxypropyl)propane-2-sulfonamide Formula: C20H27FN2O3S MolecularWeight: 394.503383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)N(CC(C)O)C1=CC=C(C=C1)C2=CC(=C(C=C2)CCN)F

Isomeric SMILES

CC(C)S(=O)(=O)N(CC(C)O)C1=CC=C(C=C1)C2=CC(=C(C=C2)CCN)F

InChI

InChI=1S/C20H27FN2O3S/c1-14(2)27(25,26)23(13-15(3)24)19-8-6-16(7-9-19)18-5-4-17(10-11-22)20(21)12-18/h4-9,12,14-15,24H,10-11,13,22H2,1-3H3