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

Systemtic Name: 5-[[5-fluoranyl-4-(quinolin-3-ylamino)pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide Openeye Name: 5-[[5-fluoro-4-(3-quinolylamino)pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide CAS Name: 5-[[5-fluoro-4-(3-quinolinylamino)-2-pyrimidinyl]amino]-2-methylbenzenesulfonamide IUPAC Name: 5-[[5-fluoro-4-(quinolin-3-ylamino)pyrimidin-2-yl]amino]-2-methylbenzenesulfonamide Traditional Name: 5-[[5-fluoro-4-(3-quinolylamino)pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide Formula: C20H17FN6O2S MolecularWeight: 424.451383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC=C(C(=N2)NC3=CC4=CC=CC=C4N=C3)F)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC=C(C(=N2)NC3=CC4=CC=CC=C4N=C3)F)S(=O)(=O)N

InChI

InChI=1S/C20H17FN6O2S/c1-12-6-7-14(9-18(12)30(22,28)29)26-20-24-11-16(21)19(27-20)25-15-8-13-4-2-3-5-17(13)23-10-15/h2-11H,1H3,(H2,22,28,29)(H2,24,25,26,27)