5-[[5-fluoranyl-4-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)amino]pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide

Systemtic Name: 5-[[5-fluoranyl-4-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)amino]pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide Openeye Name: 5-[[5-fluoro-4-[(3-oxo-4H-1,4-benzothiazin-6-yl)amino]pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide CAS Name: 5-[[5-fluoro-4-[(3-oxo-4H-1,4-benzothiazin-6-yl)amino]-2-pyrimidinyl]amino]-2-methylbenzenesulfonamide IUPAC Name: 5-[[5-fluoro-4-[(3-oxo-4H-1,4-benzothiazin-6-yl)amino]pyrimidin-2-yl]amino]-2-methylbenzenesulfonamide Traditional Name: 5-[[5-fluoro-4-[(3-keto-4H-1,4-benzothiazin-6-yl)amino]pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide Formula: C19H17FN6O3S2 MolecularWeight: 460.505083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC=C(C(=N2)NC3=CC4=C(C=C3)SCC(=O)N4)F)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC=C(C(=N2)NC3=CC4=C(C=C3)SCC(=O)N4)F)S(=O)(=O)N

InChI

InChI=1S/C19H17FN6O3S2/c1-10-2-3-12(7-16(10)31(21,28)29)24-19-22-8-13(20)18(26-19)23-11-4-5-15-14(6-11)25-17(27)9-30-15/h2-8H,9H2,1H3,(H,25,27)(H2,21,28,29)(H2,22,23,24,26)