(3R,5S)-5-[4-(3-chloranyl-4-fluoranyl-phenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]-1-naphthalen-2-ylsulfonyl-pyrrolidine-3-thiol

Systemtic Name: (3R,5S)-5-[4-(3-chloranyl-4-fluoranyl-phenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]-1-naphthalen-2-ylsulfonyl-pyrrolidine-3-thiol Openeye Name: (3R,5S)-5-[4-(3-chloro-4-fluoro-phenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]-1-(2-naphthylsulfonyl)pyrrolidine-3-thiol CAS Name: (3R,5S)-5-[4-(3-chloro-4-fluorophenyl)-5-(methylthio)-1,2,4-triazol-3-yl]-1-(2-naphthalenylsulfonyl)-3-pyrrolidinethiol IUPAC Name: (3R,5S)-5-[4-(3-chloro-4-fluorophenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]-1-naphthalen-2-ylsulfonylpyrrolidine-3-thiol Traditional Name: (3R,5S)-5-[4-(3-chloro-4-fluoro-phenyl)-5-(methylthio)-1,2,4-triazol-3-yl]-1-(2-naphthylsulfonyl)pyrrolidine-3-thiol Formula: C23H20ClFN4O2S3 MolecularWeight: 535.076903

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1C2=CC(=C(C=C2)F)Cl)C3CC(CN3S(=O)(=O)C4=CC5=CC=CC=C5C=C4)S

Isomeric SMILES

CSC1=NN=C(N1C2=CC(=C(C=C2)F)Cl)[C@@H]3C[C@H](CN3S(=O)(=O)C4=CC5=CC=CC=C5C=C4)S

InChI

InChI=1S/C23H20ClFN4O2S3/c1-33-23-27-26-22(29(23)16-7-9-20(25)19(24)11-16)21-12-17(32)13-28(21)34(30,31)18-8-6-14-4-2-3-5-15(14)10-18/h2-11,17,21,32H,12-13H2,1H3/t17-,21+/m1/s1