N-[4-(1-adamantyl)phenyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-(1-adamantyl)phenyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-(1-adamantyl)phenyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[4-(1-adamantyl)phenyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(1-adamantyl)phenyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(1-adamantyl)phenyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C26H32N2O3S2 MolecularWeight: 484.67388

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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)C6=CC=CS6

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)S(=O)(=O)C6=CC=CS6

InChI

InChI=1S/C26H32N2O3S2/c29-25(21-7-9-28(10-8-21)33(30,31)24-2-1-11-32-24)27-23-5-3-22(4-6-23)26-15-18-12-19(16-26)14-20(13-18)17-26/h1-6,11,18-21H,7-10,12-17H2,(H,27,29)