5-[[bis(phenylmethyl)amino]methyl]-1-naphthalen-2-ylsulfonyl-pyrrolidine-3-thiol

Systemtic Name: 5-[[bis(phenylmethyl)amino]methyl]-1-naphthalen-2-ylsulfonyl-pyrrolidine-3-thiol Openeye Name: 5-[(dibenzylamino)methyl]-1-(2-naphthylsulfonyl)pyrrolidine-3-thiol CAS Name: 5-[[bis(phenylmethyl)amino]methyl]-1-(2-naphthalenylsulfonyl)-3-pyrrolidinethiol IUPAC Name: 5-[(dibenzylamino)methyl]-1-naphthalen-2-ylsulfonylpyrrolidine-3-thiol Traditional Name: 5-[(dibenzylamino)methyl]-1-(2-naphthylsulfonyl)pyrrolidine-3-thiol Formula: C29H30N2O2S2 MolecularWeight: 502.6907

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1CN(CC2=CC=CC=C2)CC3=CC=CC=C3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)S

Isomeric SMILES

C1C(CN(C1CN(CC2=CC=CC=C2)CC3=CC=CC=C3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)S

InChI

InChI=1S/C29H30N2O2S2/c32-35(33,29-16-15-25-13-7-8-14-26(25)17-29)31-22-28(34)18-27(31)21-30(19-23-9-3-1-4-10-23)20-24-11-5-2-6-12-24/h1-17,27-28,34H,18-22H2