2-[1-methylsulfonyl-4-(triphenylmethyl)sulfanyl-pyrrolidin-2-yl]ethanoic acid

Systemtic Name: 2-[1-methylsulfonyl-4-(triphenylmethyl)sulfanyl-pyrrolidin-2-yl]ethanoic acid Openeye Name: 2-(1-methylsulfonyl-4-tritylsulfanyl-pyrrolidin-2-yl)acetic acid CAS Name: 2-[1-methylsulfonyl-4-[(triphenylmethyl)thio]-2-pyrrolidinyl]acetic acid IUPAC Name: 2-(1-methylsulfonyl-4-tritylsulfanylpyrrolidin-2-yl)acetic acid Traditional Name: 2-[1-mesyl-4-(tritylthio)pyrrolidin-2-yl]acetic acid Formula: C26H27NO4S2 MolecularWeight: 481.62688

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC(CC1CC(=O)O)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)N1CC(CC1CC(=O)O)SC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H27NO4S2/c1-33(30,31)27-19-24(17-23(27)18-25(28)29)32-26(20-11-5-2-6-12-20,21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-16,23-24H,17-19H2,1H3,(H,28,29)