methyl 2-[3-phenylsulfanyl-1-(phenylsulfonyl)indol-2-yl]ethanoate

Systemtic Name: methyl 2-[3-phenylsulfanyl-1-(phenylsulfonyl)indol-2-yl]ethanoate Openeye Name: methyl 2-[1-(benzenesulfonyl)-3-phenylsulfanyl-indol-2-yl]acetate CAS Name: 2-[1-(benzenesulfonyl)-3-(phenylthio)-2-indolyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-(benzenesulfonyl)-3-phenylsulfanylindol-2-yl]acetate Traditional Name: 2-[1-besyl-3-(phenylthio)indol-2-yl]acetic acid methyl ester Formula: C23H19NO4S2 MolecularWeight: 437.53126

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(C2=CC=CC=C2N1S(=O)(=O)C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

COC(=O)CC1=C(C2=CC=CC=C2N1S(=O)(=O)C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C23H19NO4S2/c1-28-22(25)16-21-23(29-17-10-4-2-5-11-17)19-14-8-9-15-20(19)24(21)30(26,27)18-12-6-3-7-13-18/h2-15H,16H2,1H3