N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-bromo-2-isopropyl-5-methyl-phenoxy)acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)acetamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-(4-bromo-2-isopropyl-5-methyl-phenoxy)acetamide Formula: C24H31BrN2O4S MolecularWeight: 523.48294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C24H31BrN2O4S/c1-17(2)21-15-22(25)18(3)14-23(21)31-16-24(28)26-19-8-10-20(11-9-19)32(29,30)27-12-6-4-5-7-13-27/h8-11,14-15,17H,4-7,12-13,16H2,1-3H3,(H,26,28)