2-(3-bromanyl-1-adamantyl)-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(3-bromanyl-1-adamantyl)-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(3-bromo-1-adamantyl)-N-[4-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-(3-bromo-1-adamantyl)-N-[4-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(3-bromo-1-adamantyl)-N-(4-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(3-bromo-1-adamantyl)-N-(4-piperidinosulfonylphenyl)acetamide Formula: C23H31BrN2O3S MolecularWeight: 495.47284

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)Br

InChI

InChI=1S/C23H31BrN2O3S/c24-23-13-17-10-18(14-23)12-22(11-17,16-23)15-21(27)25-19-4-6-20(7-5-19)30(28,29)26-8-2-1-3-9-26/h4-7,17-18H,1-3,8-16H2,(H,25,27)