N-(2,3-dihydro-1-benzofuran-5-yl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,3-dihydro-1-benzofuran-5-yl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2,3-dihydrobenzofuran-5-yl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(2,3-dihydrobenzofuran-5-yl)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(2,3-dihydro-1-benzofuran-5-yl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-coumaran-5-yl-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC3=C(C=C2)OCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC3=C(C=C2)OCC3)C

InChI

InChI=1S/C16H17N3O2S/c1-10-7-11(2)18-16(17-10)22-9-15(20)19-13-3-4-14-12(8-13)5-6-21-14/h3-4,7-8H,5-6,9H2,1-2H3,(H,19,20)