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

Systemtic Name: 3-bromanyl-N-methyl-N-[1-[(4-propan-2-ylphenyl)methyl]pyrrolidin-3-yl]benzenesulfonamide Openeye Name: 3-bromo-N-[1-[(4-isopropylphenyl)methyl]pyrrolidin-3-yl]-N-methyl-benzenesulfonamide CAS Name: 3-bromo-N-methyl-N-[1-[(4-propan-2-ylphenyl)methyl]-3-pyrrolidinyl]benzenesulfonamide IUPAC Name: 3-bromo-N-methyl-N-[1-[(4-propan-2-ylphenyl)methyl]pyrrolidin-3-yl]benzenesulfonamide Traditional Name: 3-bromo-N-[1-(4-isopropylbenzyl)pyrrolidin-3-yl]-N-methyl-benzenesulfonamide Formula: C21H27BrN2O2S MolecularWeight: 451.42028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCC(C2)N(C)S(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCC(C2)N(C)S(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H27BrN2O2S/c1-16(2)18-9-7-17(8-10-18)14-24-12-11-20(15-24)23(3)27(25,26)21-6-4-5-19(22)13-21/h4-10,13,16,20H,11-12,14-15H2,1-3H3