2,2,2-tris(fluoranyl)-N-(7-methyl-4-oxidanylidene-2-sulfanylidene-1H-benzo[g]pteridin-8-yl)ethanamide

Systemtic Name: 2,2,2-tris(fluoranyl)-N-(7-methyl-4-oxidanylidene-2-sulfanylidene-1H-benzo[g]pteridin-8-yl)ethanamide Openeye Name: 2,2,2-trifluoro-N-(7-methyl-4-oxo-2-thioxo-1H-benzo[g]pteridin-8-yl)acetamide CAS Name: 2,2,2-trifluoro-N-(7-methyl-4-oxo-2-sulfanylidene-1H-benzo[g]pteridin-8-yl)acetamide IUPAC Name: 2,2,2-trifluoro-N-(7-methyl-4-oxo-2-sulfanylidene-1H-benzo[g]pteridin-8-yl)acetamide Traditional Name: 2,2,2-trifluoro-N-(4-keto-7-methyl-2-thioxo-1H-benzo[g]pteridin-8-yl)acetamide Formula: C13H8F3N5O2S MolecularWeight: 355.29513

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1NC(=O)C(F)(F)F)N=C3C(=N2)C(=O)NC(=S)N3

Isomeric SMILES

CC1=CC2=C(C=C1NC(=O)C(F)(F)F)N=C3C(=N2)C(=O)NC(=S)N3

InChI

InChI=1S/C13H8F3N5O2S/c1-4-2-6-7(3-5(4)19-11(23)13(14,15)16)18-9-8(17-6)10(22)21-12(24)20-9/h2-3H,1H3,(H,19,23)(H2,18,20,21,22,24)