2-(5-azanyl-6-oxidanylidene-2-thiophen-2-yl-pyrimidin-1-yl)-N-[1,1,1-tris(fluoranyl)-4-methyl-2-oxidanylidene-pentan-3-yl]ethanamide

Systemtic Name: 2-(5-azanyl-6-oxidanylidene-2-thiophen-2-yl-pyrimidin-1-yl)-N-[1,1,1-tris(fluoranyl)-4-methyl-2-oxidanylidene-pentan-3-yl]ethanamide Openeye Name: 2-[5-amino-6-oxo-2-(2-thienyl)pyrimidin-1-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-oxo-propyl)acetamide CAS Name: 2-(5-amino-6-oxo-2-thiophen-2-yl-1-pyrimidinyl)-N-(1,1,1-trifluoro-4-methyl-2-oxopentan-3-yl)acetamide IUPAC Name: 2-(5-amino-6-oxo-2-thiophen-2-ylpyrimidin-1-yl)-N-(1,1,1-trifluoro-4-methyl-2-oxopentan-3-yl)acetamide Traditional Name: 2-[5-amino-6-keto-2-(2-thienyl)pyrimidin-1-yl]-N-(3,3,3-trifluoro-1-isopropyl-2-keto-propyl)acetamide Formula: C16H17F3N4O3S MolecularWeight: 402.39139

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C(F)(F)F)NC(=O)CN1C(=NC=C(C1=O)N)C2=CC=CS2

Isomeric SMILES

CC(C)C(C(=O)C(F)(F)F)NC(=O)CN1C(=NC=C(C1=O)N)C2=CC=CS2

InChI

InChI=1S/C16H17F3N4O3S/c1-8(2)12(13(25)16(17,18)19)22-11(24)7-23-14(10-4-3-5-27-10)21-6-9(20)15(23)26/h3-6,8,12H,7,20H2,1-2H3,(H,22,24)