1-naphthalen-2-ylsulfonyl-5-[(2-phenylmethoxyethylamino)methyl]pyrrolidine-3-thiol

Systemtic Name: 1-naphthalen-2-ylsulfonyl-5-[(2-phenylmethoxyethylamino)methyl]pyrrolidine-3-thiol Openeye Name: 5-[(2-benzyloxyethylamino)methyl]-1-(2-naphthylsulfonyl)pyrrolidine-3-thiol CAS Name: 1-(2-naphthalenylsulfonyl)-5-[(2-phenylmethoxyethylamino)methyl]-3-pyrrolidinethiol IUPAC Name: 1-naphthalen-2-ylsulfonyl-5-[(2-phenylmethoxyethylamino)methyl]pyrrolidine-3-thiol Traditional Name: 5-[(2-benzoxyethylamino)methyl]-1-(2-naphthylsulfonyl)pyrrolidine-3-thiol Formula: C24H28N2O3S2 MolecularWeight: 456.62072

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1CNCCOCC2=CC=CC=C2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)S

Isomeric SMILES

C1C(CN(C1CNCCOCC2=CC=CC=C2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)S

InChI

InChI=1S/C24H28N2O3S2/c27-31(28,24-11-10-20-8-4-5-9-21(20)14-24)26-17-23(30)15-22(26)16-25-12-13-29-18-19-6-2-1-3-7-19/h1-11,14,22-23,25,30H,12-13,15-18H2