2-[(5-acetamido-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[3,5-bis(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[(5-acetamido-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[3,5-bis(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[(5-acetamido-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[3,5-bis(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(5-acetamido-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]-N-[3,5-bis(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[(5-acetamido-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[3,5-bis(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(5-acetamido-4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]-N-[3,5-bis(trifluoromethyl)phenyl]acetamide Formula: C16H12F6N4O4S MolecularWeight: 470.346299

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(N=C(NC1=O)SCC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)O

Isomeric SMILES

CC(=O)NC1=C(N=C(NC1=O)SCC(=O)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)O

InChI

InChI=1S/C16H12F6N4O4S/c1-6(27)23-11-12(29)25-14(26-13(11)30)31-5-10(28)24-9-3-7(15(17,18)19)2-8(4-9)16(20,21)22/h2-4H,5H2,1H3,(H,23,27)(H,24,28)(H2,25,26,29,30)