N-[2,4-bis(oxidanylidene)-6-pyridazin-3-yl-7-(trifluoromethyl)-1H-quinazolin-3-yl]methanesulfonamide

Systemtic Name: N-[2,4-bis(oxidanylidene)-6-pyridazin-3-yl-7-(trifluoromethyl)-1H-quinazolin-3-yl]methanesulfonamide Openeye Name: N-[2,4-dioxo-6-pyridazin-3-yl-7-(trifluoromethyl)-1H-quinazolin-3-yl]methanesulfonamide CAS Name: N-[2,4-dioxo-6-(3-pyridazinyl)-7-(trifluoromethyl)-1H-quinazolin-3-yl]methanesulfonamide IUPAC Name: N-[2,4-dioxo-6-pyridazin-3-yl-7-(trifluoromethyl)-1H-quinazolin-3-yl]methanesulfonamide Traditional Name: N-[2,4-diketo-6-pyridazin-3-yl-7-(trifluoromethyl)-1H-quinazolin-3-yl]methanesulfonamide Formula: C14H10F3N5O4S MolecularWeight: 401.32051

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NN1C(=O)C2=CC(=C(C=C2NC1=O)C(F)(F)F)C3=NN=CC=C3

Isomeric SMILES

CS(=O)(=O)NN1C(=O)C2=CC(=C(C=C2NC1=O)C(F)(F)F)C3=NN=CC=C3

InChI

InChI=1S/C14H10F3N5O4S/c1-27(25,26)21-22-12(23)8-5-7(10-3-2-4-18-20-10)9(14(15,16)17)6-11(8)19-13(22)24/h2-6,21H,1H3,(H,19,24)