N-(3-ethanoylphenyl)-2-(4-fluorophenyl)-4-methyl-6-methylsulfanyl-pyrimidine-5-carboxamide

Systemtic Name: N-(3-ethanoylphenyl)-2-(4-fluorophenyl)-4-methyl-6-methylsulfanyl-pyrimidine-5-carboxamide Openeye Name: N-(3-acetylphenyl)-2-(4-fluorophenyl)-4-methyl-6-methylsulfanyl-pyrimidine-5-carboxamide CAS Name: N-(3-acetylphenyl)-2-(4-fluorophenyl)-4-methyl-6-(methylthio)-5-pyrimidinecarboxamide IUPAC Name: N-(3-acetylphenyl)-2-(4-fluorophenyl)-4-methyl-6-methylsulfanylpyrimidine-5-carboxamide Traditional Name: N-(3-acetylphenyl)-2-(4-fluorophenyl)-4-methyl-6-(methylthio)pyrimidine-5-carboxamide Formula: C21H18FN3O2S MolecularWeight: 395.449923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=C(C=C2)F)SC)C(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=C(C=C2)F)SC)C(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C21H18FN3O2S/c1-12-18(20(27)24-17-6-4-5-15(11-17)13(2)26)21(28-3)25-19(23-12)14-7-9-16(22)10-8-14/h4-11H,1-3H3,(H,24,27)