1-[(4-methylsulfanylphenyl)methyl]-5-[(2S)-2-(phenoxymethyl)azetidin-1-yl]sulfonyl-indole-2,3-dione

Systemtic Name: 1-[(4-methylsulfanylphenyl)methyl]-5-[(2S)-2-(phenoxymethyl)azetidin-1-yl]sulfonyl-indole-2,3-dione Openeye Name: 1-[(4-methylsulfanylphenyl)methyl]-5-[(2S)-2-(phenoxymethyl)azetidin-1-yl]sulfonyl-indoline-2,3-dione CAS Name: 1-[[4-(methylthio)phenyl]methyl]-5-[[(2S)-2-(phenoxymethyl)-1-azetidinyl]sulfonyl]indole-2,3-dione IUPAC Name: 1-[(4-methylsulfanylphenyl)methyl]-5-[(2S)-2-(phenoxymethyl)azetidin-1-yl]sulfonylindole-2,3-dione Traditional Name: 1-[4-(methylthio)benzyl]-5-[(2S)-2-(phenoxymethyl)azetidin-1-yl]sulfonyl-isatin Formula: C26H24N2O5S2 MolecularWeight: 508.60916

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CCC4COC5=CC=CC=C5)C(=O)C2=O

Isomeric SMILES

CSC1=CC=C(C=C1)CN2C3=C(C=C(C=C3)S(=O)(=O)N4CC[C@H]4COC5=CC=CC=C5)C(=O)C2=O

InChI

InChI=1S/C26H24N2O5S2/c1-34-21-9-7-18(8-10-21)16-27-24-12-11-22(15-23(24)25(29)26(27)30)35(31,32)28-14-13-19(28)17-33-20-5-3-2-4-6-20/h2-12,15,19H,13-14,16-17H2,1H3/t19-/m0/s1