2-(3-bromanyl-1-adamantyl)-N-(2-methyl-5-methylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-(2-methyl-5-methylsulfonyl-phenyl)ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-(2-methyl-5-methylsulfonyl-phenyl)acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-(2-methyl-5-methylsulfonylphenyl)acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-(5-mesyl-2-methyl-phenyl)acetamide Formula: C20H26BrNO3S MolecularWeight: 440.39434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)CC23CC4CC(C2)CC(C4)(C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)CC23CC4CC(C2)CC(C4)(C3)Br

InChI

InChI=1S/C20H26BrNO3S/c1-13-3-4-16(26(2,24)25)6-17(13)22-18(23)11-19-7-14-5-15(8-19)10-20(21,9-14)12-19/h3-4,6,14-15H,5,7-12H2,1-2H3,(H,22,23)