2-[2-(2,6-dimethylpyrimidin-4-yl)sulfanylethanoylamino]-N-(3-methylphenyl)benzamide

Systemtic Name: 2-[2-(2,6-dimethylpyrimidin-4-yl)sulfanylethanoylamino]-N-(3-methylphenyl)benzamide Openeye Name: 2-[[2-(2,6-dimethylpyrimidin-4-yl)sulfanylacetyl]amino]-N-(m-tolyl)benzamide CAS Name: 2-[[2-[(2,6-dimethyl-4-pyrimidinyl)thio]-1-oxoethyl]amino]-N-(3-methylphenyl)benzamide IUPAC Name: 2-[[2-(2,6-dimethylpyrimidin-4-yl)sulfanylacetyl]amino]-N-(3-methylphenyl)benzamide Traditional Name: 2-[[2-[(2,6-dimethylpyrimidin-4-yl)thio]acetyl]amino]-N-(m-tolyl)benzamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NC(=NC(=C3)C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NC(=NC(=C3)C)C

InChI

InChI=1S/C22H22N4O2S/c1-14-7-6-8-17(11-14)25-22(28)18-9-4-5-10-19(18)26-20(27)13-29-21-12-15(2)23-16(3)24-21/h4-12H,13H2,1-3H3,(H,25,28)(H,26,27)