(E)-2-diazonio-1-[1-methylsulfonyl-4-(triphenylmethyl)sulfanyl-pyrrolidin-2-yl]ethenolate

Systemtic Name: (E)-2-diazonio-1-[1-methylsulfonyl-4-(triphenylmethyl)sulfanyl-pyrrolidin-2-yl]ethenolate Openeye Name: (E)-2-diazonio-1-(1-methylsulfonyl-4-tritylsulfanyl-pyrrolidin-2-yl)ethenolate CAS Name: (E)-2-diazonio-1-[1-methylsulfonyl-4-[(triphenylmethyl)thio]-2-pyrrolidinyl]ethenolate IUPAC Name: (E)-2-diazonio-1-(1-methylsulfonyl-4-tritylsulfanylpyrrolidin-2-yl)ethenolate Traditional Name: (E)-2-diazonio-1-[1-mesyl-4-(tritylthio)pyrrolidin-2-yl]ethenolate Formula: C26H25N3O3S2 MolecularWeight: 491.625

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC(CC1C(=C[N+]#N)[O-])SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CC(CC1/C(=C\[N+]#N)/[O-])SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H25N3O3S2/c1-34(31,32)29-19-23(17-24(29)25(30)18-28-27)33-26(20-11-5-2-6-12-20,21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-16,18,23-24H,17,19H2,1H3/b25-18+