2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[4-chloranyl-3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[4-chloranyl-3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-[4-chloro-3-(trifluoromethyl)phenyl]acetamide Formula: C13H10ClF3N4O2S MolecularWeight: 378.75731

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CSC2=NC(=O)C=C(N2)N)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CSC2=NC(=O)C=C(N2)N)C(F)(F)F)Cl

InChI

InChI=1S/C13H10ClF3N4O2S/c14-8-2-1-6(3-7(8)13(15,16)17)19-11(23)5-24-12-20-9(18)4-10(22)21-12/h1-4H,5H2,(H,19,23)(H3,18,20,21,22)