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

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[3,5-bis(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[3,5-bis(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-[3,5-bis(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-[3,5-bis(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-[3,5-bis(trifluoromethyl)phenyl]acetamide Formula: C14H10F6N4O2S MolecularWeight: 412.310219

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)NC(=O)CSC2=NC(=O)C=C(N2)N)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)NC(=O)CSC2=NC(=O)C=C(N2)N)C(F)(F)F

InChI

InChI=1S/C14H10F6N4O2S/c15-13(16,17)6-1-7(14(18,19)20)3-8(2-6)22-11(26)5-27-12-23-9(21)4-10(25)24-12/h1-4H,5H2,(H,22,26)(H3,21,23,24,25)