2-[(6-azanyl-4-oxidanylidene-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[(6-amino-4-oxo-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(6-amino-4-oxo-5-phenyl-1H-pyrimidin-2-yl)thio]-N-[2-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[(6-amino-4-oxo-5-phenyl-1H-pyrimidin-2-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(6-amino-4-keto-5-phenyl-1H-pyrimidin-2-yl)thio]-N-[2-(trifluoromethyl)phenyl]acetamide Formula: C19H15F3N4O2S MolecularWeight: 420.40821

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(NC(=NC2=O)SCC(=O)NC3=CC=CC=C3C(F)(F)F)N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(NC(=NC2=O)SCC(=O)NC3=CC=CC=C3C(F)(F)F)N

InChI

InChI=1S/C19H15F3N4O2S/c20-19(21,22)12-8-4-5-9-13(12)24-14(27)10-29-18-25-16(23)15(17(28)26-18)11-6-2-1-3-7-11/h1-9H,10H2,(H,24,27)(H3,23,25,26,28)