4-bromanyl-2-ethyl-N-[1-[(4-propan-2-yloxyphenyl)methyl]pyrrolidin-3-yl]benzenesulfonamide

Systemtic Name: 4-bromanyl-2-ethyl-N-[1-[(4-propan-2-yloxyphenyl)methyl]pyrrolidin-3-yl]benzenesulfonamide Openeye Name: 4-bromo-2-ethyl-N-[1-[(4-isopropoxyphenyl)methyl]pyrrolidin-3-yl]benzenesulfonamide CAS Name: 4-bromo-2-ethyl-N-[1-[(4-propan-2-yloxyphenyl)methyl]-3-pyrrolidinyl]benzenesulfonamide IUPAC Name: 4-bromo-2-ethyl-N-[1-[(4-propan-2-yloxyphenyl)methyl]pyrrolidin-3-yl]benzenesulfonamide Traditional Name: 4-bromo-2-ethyl-N-[1-(4-isopropoxybenzyl)pyrrolidin-3-yl]benzenesulfonamide Formula: C22H29BrN2O3S MolecularWeight: 481.44626

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)NC2CCN(C2)CC3=CC=C(C=C3)OC(C)C

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)NC2CCN(C2)CC3=CC=C(C=C3)OC(C)C

InChI

InChI=1S/C22H29BrN2O3S/c1-4-18-13-19(23)7-10-22(18)29(26,27)24-20-11-12-25(15-20)14-17-5-8-21(9-6-17)28-16(2)3/h5-10,13,16,20,24H,4,11-12,14-15H2,1-3H3