N-(2-cyanophenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyanophenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-cyanophenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(2-cyanophenyl)-2-[(4,5,6-trimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(2-cyanophenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(2-cyanophenyl)-2-[(4,5,6-trimethylpyrimidin-2-yl)thio]acetamide Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1C)SCC(=O)NC2=CC=CC=C2C#N)C

Isomeric SMILES

CC1=C(N=C(N=C1C)SCC(=O)NC2=CC=CC=C2C#N)C

InChI

InChI=1S/C16H16N4OS/c1-10-11(2)18-16(19-12(10)3)22-9-15(21)20-14-7-5-4-6-13(14)8-17/h4-7H,9H2,1-3H3,(H,20,21)