N-(2,6-diethylphenyl)-2-(6-methylpyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,6-diethylphenyl)-2-(6-methylpyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(2,6-diethylphenyl)-2-(6-methylpyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(2,6-diethylphenyl)-2-[(6-methyl-4-pyrimidinyl)thio]acetamide IUPAC Name: N-(2,6-diethylphenyl)-2-(6-methylpyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(2,6-diethylphenyl)-2-[(6-methylpyrimidin-4-yl)thio]acetamide Formula: C17H21N3OS MolecularWeight: 315.43314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC=NC(=C2)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CSC2=NC=NC(=C2)C

InChI

InChI=1S/C17H21N3OS/c1-4-13-7-6-8-14(5-2)17(13)20-15(21)10-22-16-9-12(3)18-11-19-16/h6-9,11H,4-5,10H2,1-3H3,(H,20,21)