N-[[7-(3,6-dimethylpyrazin-2-yl)-4-fluoranyl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methylsulfanyl-1,3-thiazole-4-carboxamide

Systemtic Name: N-[[7-(3,6-dimethylpyrazin-2-yl)-4-fluoranyl-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methylsulfanyl-1,3-thiazole-4-carboxamide Openeye Name: N-[[7-(3,6-dimethylpyrazin-2-yl)-4-fluoro-2,3-dihydrobenzofuran-2-yl]methyl]-2-methylsulfanyl-thiazole-4-carboxamide CAS Name: N-[[7-(3,6-dimethyl-2-pyrazinyl)-4-fluoro-2,3-dihydrobenzofuran-2-yl]methyl]-2-(methylthio)-4-thiazolecarboxamide IUPAC Name: N-[[7-(3,6-dimethylpyrazin-2-yl)-4-fluoro-2,3-dihydro-1-benzofuran-2-yl]methyl]-2-methylsulfanyl-1,3-thiazole-4-carboxamide Traditional Name: N-[[7-(3,6-dimethylpyrazin-2-yl)-4-fluoro-coumaran-2-yl]methyl]-2-(methylthio)thiazole-4-carboxamide Formula: C20H19FN4O2S2 MolecularWeight: 430.518863

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=N1)C2=C3C(=C(C=C2)F)CC(O3)CNC(=O)C4=CSC(=N4)SC)C

Isomeric SMILES

CC1=CN=C(C(=N1)C2=C3C(=C(C=C2)F)CC(O3)CNC(=O)C4=CSC(=N4)SC)C

InChI

InChI=1S/C20H19FN4O2S2/c1-10-7-22-11(2)17(24-10)13-4-5-15(21)14-6-12(27-18(13)14)8-23-19(26)16-9-29-20(25-16)28-3/h4-5,7,9,12H,6,8H2,1-3H3,(H,23,26)