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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CSC2=C1C=C(C=C2)NC3=NC(=NC=C3F)NC4=CC(=CC=C4)S(=O)(=O)N

Isomeric SMILES

CN1C(=O)CSC2=C1C=C(C=C2)NC3=NC(=NC=C3F)NC4=CC(=CC=C4)S(=O)(=O)N

InChI

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