3-[[5-fluoranyl-4-[(5-oxidanylidene-7,8-dihydro-6H-naphthalen-2-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 3-[[5-fluoranyl-4-[(5-oxidanylidene-7,8-dihydro-6H-naphthalen-2-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 3-[[5-fluoro-4-[(1-oxotetralin-6-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 3-[[5-fluoro-4-[(5-oxo-7,8-dihydro-6H-naphthalen-2-yl)amino]-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 3-[[5-fluoro-4-[(5-oxo-7,8-dihydro-6H-naphthalen-2-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 3-[[5-fluoro-4-[(1-ketotetralin-6-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Formula: C20H18FN5O3S MolecularWeight: 427.452023

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC(=CC=C4)S(=O)(=O)N)C(=O)C1

Isomeric SMILES

C1CC2=C(C=CC(=C2)NC3=NC(=NC=C3F)NC4=CC(=CC=C4)S(=O)(=O)N)C(=O)C1

InChI

InChI=1S/C20H18FN5O3S/c21-17-11-23-20(25-13-4-2-5-15(10-13)30(22,28)29)26-19(17)24-14-7-8-16-12(9-14)3-1-6-18(16)27/h2,4-5,7-11H,1,3,6H2,(H2,22,28,29)(H2,23,24,25,26)