N-[(3R)-1-[(4-bromophenyl)methyl]pyrrolidin-3-yl]-5-fluoranyl-2-methyl-benzenesulfonamide

Systemtic Name: N-[(3R)-1-[(4-bromophenyl)methyl]pyrrolidin-3-yl]-5-fluoranyl-2-methyl-benzenesulfonamide Openeye Name: N-[(3R)-1-[(4-bromophenyl)methyl]pyrrolidin-3-yl]-5-fluoro-2-methyl-benzenesulfonamide CAS Name: N-[(3R)-1-[(4-bromophenyl)methyl]-3-pyrrolidinyl]-5-fluoro-2-methylbenzenesulfonamide IUPAC Name: N-[(3R)-1-[(4-bromophenyl)methyl]pyrrolidin-3-yl]-5-fluoro-2-methylbenzenesulfonamide Traditional Name: N-[(3R)-1-(4-bromobenzyl)pyrrolidin-3-yl]-5-fluoro-2-methyl-benzenesulfonamide Formula: C18H20BrFN2O2S MolecularWeight: 427.331003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)S(=O)(=O)NC2CCN(C2)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)F)S(=O)(=O)N[C@@H]2CCN(C2)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C18H20BrFN2O2S/c1-13-2-7-16(20)10-18(13)25(23,24)21-17-8-9-22(12-17)11-14-3-5-15(19)6-4-14/h2-7,10,17,21H,8-9,11-12H2,1H3/t17-/m1/s1