2-chloranyl-5-[[4-[(2-cyano-1-benzofuran-5-yl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 2-chloranyl-5-[[4-[(2-cyano-1-benzofuran-5-yl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 2-chloro-5-[[4-[(2-cyanobenzofuran-5-yl)amino]-5-fluoro-pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 2-chloro-5-[[4-[(2-cyano-5-benzofuranyl)amino]-5-fluoro-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 2-chloro-5-[[4-[(2-cyano-1-benzofuran-5-yl)amino]-5-fluoropyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 2-chloro-5-[[4-[(2-cyanobenzofuran-5-yl)amino]-5-fluoro-pyrimidin-2-yl]amino]benzenesulfonamide Formula: C19H12ClFN6O3S MolecularWeight: 458.853383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC3=NC(=NC=C3F)NC4=CC(=C(C=C4)Cl)S(=O)(=O)N)C=C(O2)C#N

Isomeric SMILES

C1=CC2=C(C=C1NC3=NC(=NC=C3F)NC4=CC(=C(C=C4)Cl)S(=O)(=O)N)C=C(O2)C#N

InChI

InChI=1S/C19H12ClFN6O3S/c20-14-3-1-12(7-17(14)31(23,28)29)26-19-24-9-15(21)18(27-19)25-11-2-4-16-10(5-11)6-13(8-22)30-16/h1-7,9H,(H2,23,28,29)(H2,24,25,26,27)