1-naphthalen-2-ylsulfonyl-5-(3-phenylpropoxymethyl)pyrrolidine-3-thiol

Systemtic Name: 1-naphthalen-2-ylsulfonyl-5-(3-phenylpropoxymethyl)pyrrolidine-3-thiol Openeye Name: 1-(2-naphthylsulfonyl)-5-(3-phenylpropoxymethyl)pyrrolidine-3-thiol CAS Name: 1-(2-naphthalenylsulfonyl)-5-(3-phenylpropoxymethyl)-3-pyrrolidinethiol IUPAC Name: 1-naphthalen-2-ylsulfonyl-5-(3-phenylpropoxymethyl)pyrrolidine-3-thiol Traditional Name: 1-(2-naphthylsulfonyl)-5-(3-phenylpropoxymethyl)pyrrolidine-3-thiol Formula: C24H27NO3S2 MolecularWeight: 441.60608

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1COCCCC2=CC=CC=C2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)S

Isomeric SMILES

C1C(CN(C1COCCCC2=CC=CC=C2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)S

InChI

InChI=1S/C24H27NO3S2/c26-30(27,24-13-12-20-10-4-5-11-21(20)15-24)25-17-23(29)16-22(25)18-28-14-6-9-19-7-2-1-3-8-19/h1-5,7-8,10-13,15,22-23,29H,6,9,14,16-18H2