N-[4-(2-adamantyl)phenyl]-2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]ethanamide

Systemtic Name: N-[4-(2-adamantyl)phenyl]-2-[(4-bromanyl-3-methyl-phenyl)-methylsulfonyl-amino]ethanamide Openeye Name: N-[4-(2-adamantyl)phenyl]-2-(4-bromo-3-methyl-N-methylsulfonyl-anilino)acetamide CAS Name: N-[4-(2-adamantyl)phenyl]-2-(4-bromo-3-methyl-N-methylsulfonylanilino)acetamide IUPAC Name: N-[4-(2-adamantyl)phenyl]-2-(4-bromo-3-methyl-N-methylsulfonylanilino)acetamide Traditional Name: N-[4-(2-adamantyl)phenyl]-2-(4-bromo-N-mesyl-3-methyl-anilino)acetamide Formula: C26H31BrN2O3S MolecularWeight: 531.50494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N(CC(=O)NC2=CC=C(C=C2)C3C4CC5CC(C4)CC3C5)S(=O)(=O)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N(CC(=O)NC2=CC=C(C=C2)C3C4CC5CC(C4)CC3C5)S(=O)(=O)C)Br

InChI

InChI=1S/C26H31BrN2O3S/c1-16-9-23(7-8-24(16)27)29(33(2,31)32)15-25(30)28-22-5-3-19(4-6-22)26-20-11-17-10-18(13-20)14-21(26)12-17/h3-9,17-18,20-21,26H,10-15H2,1-2H3,(H,28,30)