ethyl 5-[[5-methylsulfanyl-1-(phenylsulfonyl)indol-2-yl]-oxidanyl-methyl]furan-2-carboxylate

Systemtic Name: ethyl 5-[[5-methylsulfanyl-1-(phenylsulfonyl)indol-2-yl]-oxidanyl-methyl]furan-2-carboxylate Openeye Name: ethyl 5-[[1-(benzenesulfonyl)-5-methylsulfanyl-indol-2-yl]-hydroxy-methyl]furan-2-carboxylate CAS Name: 5-[[1-(benzenesulfonyl)-5-(methylthio)-2-indolyl]-hydroxymethyl]-2-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[1-(benzenesulfonyl)-5-methylsulfanylindol-2-yl]-hydroxymethyl]furan-2-carboxylate Traditional Name: 5-[[1-besyl-5-(methylthio)indol-2-yl]-hydroxy-methyl]furan-2-carboxylic acid ethyl ester Formula: C23H21NO6S2 MolecularWeight: 471.54594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(O1)C(C2=CC3=C(N2S(=O)(=O)C4=CC=CC=C4)C=CC(=C3)SC)O

Isomeric SMILES

CCOC(=O)C1=CC=C(O1)C(C2=CC3=C(N2S(=O)(=O)C4=CC=CC=C4)C=CC(=C3)SC)O

InChI

InChI=1S/C23H21NO6S2/c1-3-29-23(26)21-12-11-20(30-21)22(25)19-14-15-13-16(31-2)9-10-18(15)24(19)32(27,28)17-7-5-4-6-8-17/h4-14,22,25H,3H2,1-2H3