(3R)-1-methyl-3-oxidanyl-5-[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-3-sulfanyl-indol-2-one

Systemtic Name: (3R)-1-methyl-3-oxidanyl-5-[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-3-sulfanyl-indol-2-one Openeye Name: (3R)-3-hydroxy-1-methyl-5-[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-3-sulfanyl-indolin-2-one CAS Name: (3R)-3-hydroxy-3-mercapto-1-methyl-5-[[(2S)-2-(phenoxymethyl)-1-pyrrolidinyl]sulfonyl]-2-indolone IUPAC Name: (3R)-3-hydroxy-1-methyl-5-[(2S)-2-(phenoxymethyl)pyrrolidin-1-yl]sulfonyl-3-sulfanylindol-2-one Traditional Name: (3R)-3-hydroxy-3-mercapto-1-methyl-5-[(2S)-2-(phenoxymethyl)pyrrolidino]sulfonyl-oxindole Formula: C20H22N2O5S2 MolecularWeight: 434.52908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3COC4=CC=CC=C4)C(C1=O)(O)S

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCC[C@H]3COC4=CC=CC=C4)[C@@](C1=O)(O)S

InChI

InChI=1S/C20H22N2O5S2/c1-21-18-10-9-16(12-17(18)20(24,28)19(21)23)29(25,26)22-11-5-6-14(22)13-27-15-7-3-2-4-8-15/h2-4,7-10,12,14,24,28H,5-6,11,13H2,1H3/t14-,20+/m0/s1