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

Systemtic Name: 2-[5-ethanoyl-2-(furan-2-yl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[(3-fluoranyl-4-methyl-phenyl)methyl]ethanamide Openeye Name: 2-[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]sulfanyl-N-[(3-fluoro-4-methyl-phenyl)methyl]acetamide CAS Name: 2-[[5-acetyl-2-(2-furanyl)-6-methyl-4-pyrimidinyl]thio]-N-[(3-fluoro-4-methylphenyl)methyl]acetamide IUPAC Name: 2-[5-acetyl-2-(furan-2-yl)-6-methylpyrimidin-4-yl]sulfanyl-N-[(3-fluoro-4-methylphenyl)methyl]acetamide Traditional Name: 2-[[5-acetyl-2-(2-furyl)-6-methyl-pyrimidin-4-yl]thio]-N-(3-fluoro-4-methyl-benzyl)acetamide Formula: C21H20FN3O3S MolecularWeight: 413.465203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC(=O)CSC2=NC(=NC(=C2C(=O)C)C)C3=CC=CO3)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC(=O)CSC2=NC(=NC(=C2C(=O)C)C)C3=CC=CO3)F

InChI

InChI=1S/C21H20FN3O3S/c1-12-6-7-15(9-16(12)22)10-23-18(27)11-29-21-19(14(3)26)13(2)24-20(25-21)17-5-4-8-28-17/h4-9H,10-11H2,1-3H3,(H,23,27)