N-[[(2R)-5-fluoranyl-7-(2-methylsulfanylpyrimidin-4-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-1,3-thiazole-5-carboxamide

Systemtic Name: N-[[(2R)-5-fluoranyl-7-(2-methylsulfanylpyrimidin-4-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-1,3-thiazole-5-carboxamide Openeye Name: N-[[(2R)-5-fluoro-7-(2-methylsulfanylpyrimidin-4-yl)-2,3-dihydrobenzofuran-2-yl]methyl]thiazole-5-carboxamide CAS Name: N-[[(2R)-5-fluoro-7-[2-(methylthio)-4-pyrimidinyl]-2,3-dihydrobenzofuran-2-yl]methyl]-5-thiazolecarboxamide IUPAC Name: N-[[(2R)-5-fluoro-7-(2-methylsulfanylpyrimidin-4-yl)-2,3-dihydro-1-benzofuran-2-yl]methyl]-1,3-thiazole-5-carboxamide Traditional Name: N-[[(2R)-5-fluoro-7-[2-(methylthio)pyrimidin-4-yl]coumaran-2-yl]methyl]thiazole-5-carboxamide Formula: C18H15FN4O2S2 MolecularWeight: 402.465703

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)C2=CC(=CC3=C2OC(C3)CNC(=O)C4=CN=CS4)F

Isomeric SMILES

CSC1=NC=CC(=N1)C2=CC(=CC3=C2O[C@H](C3)CNC(=O)C4=CN=CS4)F

InChI

InChI=1S/C18H15FN4O2S2/c1-26-18-21-3-2-14(23-18)13-6-11(19)4-10-5-12(25-16(10)13)7-22-17(24)15-8-20-9-27-15/h2-4,6,8-9,12H,5,7H2,1H3,(H,22,24)/t12-/m1/s1