2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-(3-ethylphenyl)benzamide

Systemtic Name: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-(3-ethylphenyl)benzamide Openeye Name: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-(3-ethylphenyl)benzamide CAS Name: 2-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]-N-(3-ethylphenyl)benzamide IUPAC Name: 2-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]-N-(3-ethylphenyl)benzamide Traditional Name: 2-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]-N-(3-ethylphenyl)benzamide Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2CSC3=NC(=CC(=N3)C)C

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2CSC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C22H23N3OS/c1-4-17-8-7-10-19(13-17)25-21(26)20-11-6-5-9-18(20)14-27-22-23-15(2)12-16(3)24-22/h5-13H,4,14H2,1-3H3,(H,25,26)