N-[1-benzofuran-2-yl(phenyl)methyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[1-benzofuran-2-yl(phenyl)methyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[benzofuran-2-yl(phenyl)methyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[2-benzofuranyl(phenyl)methyl]-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide IUPAC Name: N-[1-benzofuran-2-yl(phenyl)methyl]-2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetamide Traditional Name: N-[benzofuran-2-yl(phenyl)methyl]-2-[(4,6-dimethylpyrimidin-2-yl)thio]acetamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC(C2=CC=CC=C2)C3=CC4=CC=CC=C4O3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC(C2=CC=CC=C2)C3=CC4=CC=CC=C4O3)C

InChI

InChI=1S/C23H21N3O2S/c1-15-12-16(2)25-23(24-15)29-14-21(27)26-22(17-8-4-3-5-9-17)20-13-18-10-6-7-11-19(18)28-20/h3-13,22H,14H2,1-2H3,(H,26,27)