N-[4-(1-adamantyl)phenyl]-1-[(4-bromophenyl)methylsulfonyl]piperidine-4-carboxamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-1-[(4-bromophenyl)methylsulfonyl]piperidine-4-carboxamide Openeye Name: N-[4-(1-adamantyl)phenyl]-1-[(4-bromophenyl)methylsulfonyl]piperidine-4-carboxamide CAS Name: N-[4-(1-adamantyl)phenyl]-1-[(4-bromophenyl)methylsulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-1-[(4-bromophenyl)methylsulfonyl]piperidine-4-carboxamide Traditional Name: N-[4-(1-adamantyl)phenyl]-1-(4-bromobenzyl)sulfonyl-isonipecotamide Formula: C29H35BrN2O3S MolecularWeight: 571.5688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)S(=O)(=O)CC6=CC=C(C=C6)Br

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)S(=O)(=O)CC6=CC=C(C=C6)Br

InChI

InChI=1S/C29H35BrN2O3S/c30-26-5-1-20(2-6-26)19-36(34,35)32-11-9-24(10-12-32)28(33)31-27-7-3-25(4-8-27)29-16-21-13-22(17-29)15-23(14-21)18-29/h1-8,21-24H,9-19H2,(H,31,33)