3-[[5-fluoranyl-4-(quinolin-6-ylamino)pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 3-[[5-fluoranyl-4-(quinolin-6-ylamino)pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 3-[[5-fluoro-4-(6-quinolylamino)pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 3-[[5-fluoro-4-(6-quinolinylamino)-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 3-[[5-fluoro-4-(quinolin-6-ylamino)pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 3-[[5-fluoro-4-(6-quinolylamino)pyrimidin-2-yl]amino]benzenesulfonamide Formula: C19H15FN6O2S MolecularWeight: 410.424803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)N)NC2=NC=C(C(=N2)NC3=CC4=C(C=C3)N=CC=C4)F

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)N)NC2=NC=C(C(=N2)NC3=CC4=C(C=C3)N=CC=C4)F

InChI

InChI=1S/C19H15FN6O2S/c20-16-11-23-19(25-13-4-1-5-15(10-13)29(21,27)28)26-18(16)24-14-6-7-17-12(9-14)3-2-8-22-17/h1-11H,(H2,21,27,28)(H2,23,24,25,26)