4-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethoxy]benzenesulfonamide

Systemtic Name: 4-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethoxy]benzenesulfonamide Openeye Name: 4-[2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylethoxy]benzenesulfonamide CAS Name: 4-[2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylethoxy]benzenesulfonamide Traditional Name: 4-[2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]ethoxy]benzenesulfonamide Formula: C19H19N3O3S2 MolecularWeight: 401.50246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCCOC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCCOC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C19H19N3O3S2/c1-14-13-18(15-5-3-2-4-6-15)22-19(21-14)26-12-11-25-16-7-9-17(10-8-16)27(20,23)24/h2-10,13H,11-12H2,1H3,(H2,20,23,24)