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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)CC3=CC=CC=C3OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC2=CC=C(C=C2)NC(=O)CC3=CC=CC=C3OC)C

InChI

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