[1,3-dimethyl-2,4-bis(oxidanylidene)pteridin-6-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [1,3-dimethyl-2,4-bis(oxidanylidene)pteridin-6-yl] tris(fluoranyl)methanesulfonate Openeye Name: (1,3-dimethyl-2,4-dioxo-pteridin-6-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (1,3-dimethyl-2,4-dioxo-6-pteridinyl) ester IUPAC Name: (1,3-dimethyl-2,4-dioxopteridin-6-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (2,4-diketo-1,3-dimethyl-pteridin-6-yl) ester Formula: C9H7F3N4O5S MolecularWeight: 340.23589

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC=C(N=C2C(=O)N(C1=O)C)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CN1C2=NC=C(N=C2C(=O)N(C1=O)C)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C9H7F3N4O5S/c1-15-6-5(7(17)16(2)8(15)18)14-4(3-13-6)21-22(19,20)9(10,11)12/h3H,1-2H3