N-[5-(1,3-benzodioxol-5-yl)-6-[2-(5-methylsulfanylpyrimidin-2-yl)oxyethoxy]pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-yl)-6-[2-(5-methylsulfanylpyrimidin-2-yl)oxyethoxy]pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide Openeye Name: N-[5-(1,3-benzodioxol-5-yl)-6-[2-(5-methylsulfanylpyrimidin-2-yl)oxyethoxy]pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide CAS Name: N-[5-(1,3-benzodioxol-5-yl)-6-[2-[[5-(methylthio)-2-pyrimidinyl]oxy]ethoxy]-4-pyrimidinyl]-4-tert-butylbenzenesulfonamide IUPAC Name: N-[5-(1,3-benzodioxol-5-yl)-6-[2-(5-methylsulfanylpyrimidin-2-yl)oxyethoxy]pyrimidin-4-yl]-4-tert-butylbenzenesulfonamide Traditional Name: N-[5-(1,3-benzodioxol-5-yl)-6-[2-[5-(methylthio)pyrimidin-2-yl]oxyethoxy]pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide Formula: C28H29N5O6S2 MolecularWeight: 595.68976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)OCCOC3=NC=C(C=N3)SC)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)OCCOC3=NC=C(C=N3)SC)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C28H29N5O6S2/c1-28(2,3)19-6-8-21(9-7-19)41(34,35)33-25-24(18-5-10-22-23(13-18)39-17-38-22)26(32-16-31-25)36-11-12-37-27-29-14-20(40-4)15-30-27/h5-10,13-16H,11-12,17H2,1-4H3,(H,31,32,33)