2-(4-bromanyl-3,5-dimethyl-phenoxy)-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(4-bromanyl-3,5-dimethyl-phenoxy)-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(4-bromo-3,5-dimethyl-phenoxy)-N-(2-methoxy-5-pyrrolidin-1-ylsulfonyl-phenyl)acetamide CAS Name: 2-(4-bromo-3,5-dimethylphenoxy)-N-[2-methoxy-5-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(4-bromo-3,5-dimethylphenoxy)-N-(2-methoxy-5-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(4-bromo-3,5-dimethyl-phenoxy)-N-(2-methoxy-5-pyrrolidinosulfonyl-phenyl)acetamide Formula: C21H25BrN2O5S MolecularWeight: 497.4026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Br)C)OCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)OC

Isomeric SMILES

CC1=CC(=CC(=C1Br)C)OCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)OC

InChI

InChI=1S/C21H25BrN2O5S/c1-14-10-16(11-15(2)21(14)22)29-13-20(25)23-18-12-17(6-7-19(18)28-3)30(26,27)24-8-4-5-9-24/h6-7,10-12H,4-5,8-9,13H2,1-3H3,(H,23,25)