(3R,5S)-1-naphthalen-2-ylsulfonyl-5-(4-phenyl-5-propylsulfanyl-1,2,4-triazol-3-yl)pyrrolidine-3-thiol

Systemtic Name: (3R,5S)-1-naphthalen-2-ylsulfonyl-5-(4-phenyl-5-propylsulfanyl-1,2,4-triazol-3-yl)pyrrolidine-3-thiol Openeye Name: (3R,5S)-1-(2-naphthylsulfonyl)-5-(4-phenyl-5-propylsulfanyl-1,2,4-triazol-3-yl)pyrrolidine-3-thiol CAS Name: (3R,5S)-1-(2-naphthalenylsulfonyl)-5-[4-phenyl-5-(propylthio)-1,2,4-triazol-3-yl]-3-pyrrolidinethiol IUPAC Name: (3R,5S)-1-naphthalen-2-ylsulfonyl-5-(4-phenyl-5-propylsulfanyl-1,2,4-triazol-3-yl)pyrrolidine-3-thiol Traditional Name: (3R,5S)-1-(2-naphthylsulfonyl)-5-[4-phenyl-5-(propylthio)-1,2,4-triazol-3-yl]pyrrolidine-3-thiol Formula: C25H26N4O2S3 MolecularWeight: 510.69454

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(N1C2=CC=CC=C2)C3CC(CN3S(=O)(=O)C4=CC5=CC=CC=C5C=C4)S

Isomeric SMILES

CCCSC1=NN=C(N1C2=CC=CC=C2)[C@@H]3C[C@H](CN3S(=O)(=O)C4=CC5=CC=CC=C5C=C4)S

InChI

InChI=1S/C25H26N4O2S3/c1-2-14-33-25-27-26-24(29(25)20-10-4-3-5-11-20)23-16-21(32)17-28(23)34(30,31)22-13-12-18-8-6-7-9-19(18)15-22/h3-13,15,21,23,32H,2,14,16-17H2,1H3/t21-,23+/m1/s1