N-[6-(2-hydroxyethyloxy)-5-[(2-methoxyphenyl)methyl]pyrimidin-4-yl]-4-methylsulfanyl-benzenesulfonamide

Systemtic Name: N-[6-(2-hydroxyethyloxy)-5-[(2-methoxyphenyl)methyl]pyrimidin-4-yl]-4-methylsulfanyl-benzenesulfonamide Openeye Name: N-[6-(2-hydroxyethoxy)-5-[(2-methoxyphenyl)methyl]pyrimidin-4-yl]-4-methylsulfanyl-benzenesulfonamide CAS Name: N-[6-(2-hydroxyethoxy)-5-[(2-methoxyphenyl)methyl]-4-pyrimidinyl]-4-(methylthio)benzenesulfonamide IUPAC Name: N-[6-(2-hydroxyethoxy)-5-[(2-methoxyphenyl)methyl]pyrimidin-4-yl]-4-methylsulfanylbenzenesulfonamide Traditional Name: N-[6-(2-hydroxyethoxy)-5-o-anisyl-pyrimidin-4-yl]-4-(methylthio)benzenesulfonamide Formula: C21H23N3O5S2 MolecularWeight: 461.55442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CC2=C(N=CN=C2OCCO)NS(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

COC1=CC=CC=C1CC2=C(N=CN=C2OCCO)NS(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C21H23N3O5S2/c1-28-19-6-4-3-5-15(19)13-18-20(22-14-23-21(18)29-12-11-25)24-31(26,27)17-9-7-16(30-2)8-10-17/h3-10,14,25H,11-13H2,1-2H3,(H,22,23,24)