N-[6-azanyl-2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide

Systemtic Name: N-[6-azanyl-2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide Openeye Name: N-[6-amino-2-[2-(methylamino)-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide CAS Name: N-[6-amino-2-[[2-(methylamino)-2-oxoethyl]thio]-4-oxo-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide IUPAC Name: N-[6-amino-2-[2-(methylamino)-2-oxoethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide Traditional Name: N-[6-amino-4-keto-2-[[2-keto-2-(methylamino)ethyl]thio]-1H-pyrimidin-5-yl]-4-(trifluoromethyl)benzamide Formula: C15H14F3N5O3S MolecularWeight: 401.36357

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CNC(=O)CSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C15H14F3N5O3S/c1-20-9(24)6-27-14-22-11(19)10(13(26)23-14)21-12(25)7-2-4-8(5-3-7)15(16,17)18/h2-5H,6H2,1H3,(H,20,24)(H,21,25)(H3,19,22,23,26)