4-tert-butyl-N-[2-(hydroxymethyl)-6-methoxy-5-(2-methoxyphenyl)sulfanyl-pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[2-(hydroxymethyl)-6-methoxy-5-(2-methoxyphenyl)sulfanyl-pyrimidin-4-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[2-(hydroxymethyl)-6-methoxy-5-(2-methoxyphenyl)sulfanyl-pyrimidin-4-yl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[2-(hydroxymethyl)-6-methoxy-5-[(2-methoxyphenyl)thio]-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[2-(hydroxymethyl)-6-methoxy-5-(2-methoxyphenyl)sulfanylpyrimidin-4-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[6-methoxy-5-[(2-methoxyphenyl)thio]-2-methylol-pyrimidin-4-yl]benzenesulfonamide Formula: C23H27N3O5S2 MolecularWeight: 489.60758

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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)CO)OC)SC3=CC=CC=C3OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)CO)OC)SC3=CC=CC=C3OC

InChI

InChI=1S/C23H27N3O5S2/c1-23(2,3)15-10-12-16(13-11-15)33(28,29)26-21-20(22(31-5)25-19(14-27)24-21)32-18-9-7-6-8-17(18)30-4/h6-13,27H,14H2,1-5H3,(H,24,25,26)