N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-2-(3-methylphenoxy)ethanamide

Systemtic Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-2-(3-methylphenoxy)ethanamide Openeye Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-2-(3-methylphenoxy)acetamide CAS Name: N-[4-[(4,6-dimethyl-2-pyrimidinyl)thio]phenyl]-2-(3-methylphenoxy)acetamide IUPAC Name: N-[4-(4,6-dimethylpyrimidin-2-yl)sulfanylphenyl]-2-(3-methylphenoxy)acetamide Traditional Name: N-[4-[(4,6-dimethylpyrimidin-2-yl)thio]phenyl]-2-(3-methylphenoxy)acetamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC2=CC=C(C=C2)SC3=NC(=CC(=N3)C)C

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC2=CC=C(C=C2)SC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C21H21N3O2S/c1-14-5-4-6-18(11-14)26-13-20(25)24-17-7-9-19(10-8-17)27-21-22-15(2)12-16(3)23-21/h4-12H,13H2,1-3H3,(H,24,25)