2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(1-phenylethyl)ethanamide

Systemtic Name: 2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(1-phenylethyl)ethanamide Openeye Name: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(1-phenylethyl)acetamide CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-(1-phenylethyl)acetamide IUPAC Name: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-(1-phenylethyl)acetamide Traditional Name: 2-[[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]thio]-N-(1-phenylethyl)acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CO2)SCC(=O)NC(C)C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CO2)SCC(=O)NC(C)C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C21H21N3O3S/c1-13(16-8-5-4-6-9-16)22-18(26)12-28-21-19(15(3)25)14(2)23-20(24-21)17-10-7-11-27-17/h4-11,13H,12H2,1-3H3,(H,22,26)