N-[2-(1-adamantylsulfanyl)ethyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide

Systemtic Name: N-[2-(1-adamantylsulfanyl)ethyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide Openeye Name: N-[2-(1-adamantylsulfanyl)ethyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide CAS Name: N-[2-(1-adamantylthio)ethyl]-4-(2-oxo-1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-[2-(1-adamantylsulfanyl)ethyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide Traditional Name: N-[2-(1-adamantylthio)ethyl]-4-(2-ketopyrrolidino)benzenesulfonamide Formula: C22H30N2O3S2 MolecularWeight: 434.6152

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)NCCSC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)NCCSC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H30N2O3S2/c25-21-2-1-8-24(21)19-3-5-20(6-4-19)29(26,27)23-7-9-28-22-13-16-10-17(14-22)12-18(11-16)15-22/h3-6,16-18,23H,1-2,7-15H2