2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(3-ethylphenyl)ethanamide

Systemtic Name: 2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(3-ethylphenyl)ethanamide Openeye Name: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-(3-ethylphenyl)acetamide CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-(3-ethylphenyl)acetamide IUPAC Name: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-(3-ethylphenyl)acetamide Traditional Name: 2-[[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]thio]-N-(3-ethylphenyl)acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)CSC2=NC(=NC(=C2C(=O)C)C)C3=CC=CO3

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)CSC2=NC(=NC(=C2C(=O)C)C)C3=CC=CO3

InChI

InChI=1S/C21H21N3O3S/c1-4-15-7-5-8-16(11-15)23-18(26)12-28-21-19(14(3)25)13(2)22-20(24-21)17-9-6-10-27-17/h5-11H,4,12H2,1-3H3,(H,23,26)