N-(6-acetamido-2-ethylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)-4-fluoranyl-benzamide

Systemtic Name: N-(6-acetamido-2-ethylsulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl)-4-fluoranyl-benzamide Openeye Name: N-(6-acetamido-2-ethylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-4-fluoro-benzamide CAS Name: N-[6-acetamido-2-(ethylthio)-4-oxo-1H-pyrimidin-5-yl]-4-fluorobenzamide IUPAC Name: N-(6-acetamido-2-ethylsulfanyl-4-oxo-1H-pyrimidin-5-yl)-4-fluorobenzamide Traditional Name: N-[6-acetamido-2-(ethylthio)-4-keto-1H-pyrimidin-5-yl]-4-fluoro-benzamide Formula: C15H15FN4O3S MolecularWeight: 350.368003

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=O)C(=C(N1)NC(=O)C)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCSC1=NC(=O)C(=C(N1)NC(=O)C)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C15H15FN4O3S/c1-3-24-15-19-12(17-8(2)21)11(14(23)20-15)18-13(22)9-4-6-10(16)7-5-9/h4-7H,3H2,1-2H3,(H,18,22)(H2,17,19,20,21,23)