2-(4-bromanyl-2,6-dimethyl-phenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(4-bromanyl-2,6-dimethyl-phenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-(4-bromo-2,6-dimethylphenoxy)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(4-bromo-2,6-dimethylphenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(4-bromo-2,6-dimethyl-phenoxy)-N-(4-pyrrolidinosulfonylphenyl)acetamide Formula: C20H23BrN2O4S MolecularWeight: 467.37662

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3)C)Br

InChI

InChI=1S/C20H23BrN2O4S/c1-14-11-16(21)12-15(2)20(14)27-13-19(24)22-17-5-7-18(8-6-17)28(25,26)23-9-3-4-10-23/h5-8,11-12H,3-4,9-10,13H2,1-2H3,(H,22,24)