2-(5-cyano-2-ethyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide

Systemtic Name: 2-(5-cyano-2-ethyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanamide Openeye Name: 2-(5-cyano-2-ethyl-6-methyl-pyrimidin-4-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide CAS Name: 2-[(5-cyano-2-ethyl-6-methyl-4-pyrimidinyl)thio]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide IUPAC Name: 2-(5-cyano-2-ethyl-6-methylpyrimidin-4-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Traditional Name: 2-[(5-cyano-2-ethyl-6-methyl-pyrimidin-4-yl)thio]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide Formula: C18H18N4O3S MolecularWeight: 370.42552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)SCC(=O)NC2=CC3=C(C=C2)OCCO3)C#N)C

Isomeric SMILES

CCC1=NC(=C(C(=N1)SCC(=O)NC2=CC3=C(C=C2)OCCO3)C#N)C

InChI

InChI=1S/C18H18N4O3S/c1-3-16-20-11(2)13(9-19)18(22-16)26-10-17(23)21-12-4-5-14-15(8-12)25-7-6-24-14/h4-5,8H,3,6-7,10H2,1-2H3,(H,21,23)