4-bromanyl-2-ethyl-N-[1-(quinolin-4-ylmethyl)pyrrolidin-3-yl]benzenesulfonamide

Systemtic Name: 4-bromanyl-2-ethyl-N-[1-(quinolin-4-ylmethyl)pyrrolidin-3-yl]benzenesulfonamide Openeye Name: 4-bromo-2-ethyl-N-[1-(4-quinolylmethyl)pyrrolidin-3-yl]benzenesulfonamide CAS Name: 4-bromo-2-ethyl-N-[1-(4-quinolinylmethyl)-3-pyrrolidinyl]benzenesulfonamide IUPAC Name: 4-bromo-2-ethyl-N-[1-(quinolin-4-ylmethyl)pyrrolidin-3-yl]benzenesulfonamide Traditional Name: 4-bromo-2-ethyl-N-[1-(4-quinolylmethyl)pyrrolidin-3-yl]benzenesulfonamide Formula: C22H24BrN3O2S MolecularWeight: 474.41386

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)NC2CCN(C2)CC3=CC=NC4=CC=CC=C34

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)NC2CCN(C2)CC3=CC=NC4=CC=CC=C34

InChI

InChI=1S/C22H24BrN3O2S/c1-2-16-13-18(23)7-8-22(16)29(27,28)25-19-10-12-26(15-19)14-17-9-11-24-21-6-4-3-5-20(17)21/h3-9,11,13,19,25H,2,10,12,14-15H2,1H3