2-(2-azanyl-6-chloranyl-5-methanoyl-pyrimidin-4-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(2-azanyl-6-chloranyl-5-methanoyl-pyrimidin-4-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(2-amino-6-chloro-5-formyl-pyrimidin-4-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(2-amino-6-chloro-5-formyl-4-pyrimidinyl)thio]-N-[3-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(2-amino-6-chloro-5-formylpyrimidin-4-yl)sulfanyl-N-[3-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(2-amino-6-chloro-5-formyl-pyrimidin-4-yl)thio]-N-[3-(trifluoromethyl)phenyl]acetamide Formula: C14H10ClF3N4O2S MolecularWeight: 390.76801

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H10ClF3N4O2S/c15-11-9(5-23)12(22-13(19)21-11)25-6-10(24)20-8-3-1-2-7(4-8)14(16,17)18/h1-5H,6H2,(H,20,24)(H2,19,21,22)