4-(1,3-dioxolan-2-yl)-1-methylsulfanyl-1-methylsulfinyl-2-[1-(phenylsulfonyl)pyrrol-3-yl]butan-2-ol

Systemtic Name: 4-(1,3-dioxolan-2-yl)-1-methylsulfanyl-1-methylsulfinyl-2-[1-(phenylsulfonyl)pyrrol-3-yl]butan-2-ol Openeye Name: 2-[1-(benzenesulfonyl)pyrrol-3-yl]-4-(1,3-dioxolan-2-yl)-1-methylsulfanyl-1-methylsulfinyl-butan-2-ol CAS Name: 2-[1-(benzenesulfonyl)-3-pyrrolyl]-4-(1,3-dioxolan-2-yl)-1-methylsulfinyl-1-(methylthio)-2-butanol IUPAC Name: 2-[1-(benzenesulfonyl)pyrrol-3-yl]-4-(1,3-dioxolan-2-yl)-1-methylsulfanyl-1-methylsulfinylbutan-2-ol Traditional Name: 2-(1-besylpyrrol-3-yl)-4-(1,3-dioxolan-2-yl)-1-methylsulfinyl-1-(methylthio)butan-2-ol Formula: C19H25NO6S3 MolecularWeight: 459.5999

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Descriptors Computed from Structure

Canonical SMILES:

CSC(C(CCC1OCCO1)(C2=CN(C=C2)S(=O)(=O)C3=CC=CC=C3)O)S(=O)C

Isomeric SMILES

CSC(C(CCC1OCCO1)(C2=CN(C=C2)S(=O)(=O)C3=CC=CC=C3)O)S(=O)C

InChI

InChI=1S/C19H25NO6S3/c1-27-18(28(2)22)19(21,10-8-17-25-12-13-26-17)15-9-11-20(14-15)29(23,24)16-6-4-3-5-7-16/h3-7,9,11,14,17-18,21H,8,10,12-13H2,1-2H3