2-[[4-[[(2R)-1-ethoxy-4-methyl-1-oxidanylidene-pentan-2-yl]sulfamoyl]phenyl]methylsulfanyl]-6-methyl-pyrimidin-4-olate

Systemtic Name: 2-[[4-[[(2R)-1-ethoxy-4-methyl-1-oxidanylidene-pentan-2-yl]sulfamoyl]phenyl]methylsulfanyl]-6-methyl-pyrimidin-4-olate Openeye Name: 2-[[4-[[(1R)-1-ethoxycarbonyl-3-methyl-butyl]sulfamoyl]phenyl]methylsulfanyl]-6-methyl-pyrimidin-4-olate CAS Name: 2-[[4-[[(2R)-1-ethoxy-4-methyl-1-oxopentan-2-yl]sulfamoyl]phenyl]methylthio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[[4-[[(2R)-1-ethoxy-4-methyl-1-oxopentan-2-yl]sulfamoyl]phenyl]methylsulfanyl]-6-methylpyrimidin-4-olate Traditional Name: 2-[[4-[[(1R)-1-carbethoxy-3-methyl-butyl]sulfamoyl]benzyl]thio]-6-methyl-pyrimidin-4-olate Formula: C20H26N3O5S2- MolecularWeight: 452.56754

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)[O-])C

Isomeric SMILES

CCOC(=O)[C@@H](CC(C)C)NS(=O)(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)[O-])C

InChI

InChI=1S/C20H27N3O5S2/c1-5-28-19(25)17(10-13(2)3)23-30(26,27)16-8-6-15(7-9-16)12-29-20-21-14(4)11-18(24)22-20/h6-9,11,13,17,23H,5,10,12H2,1-4H3,(H,21,22,24)/p-1/t17-/m1/s1