N-[2-[[7-chloranyl-2-(phenylmethyl)quinazolin-4-yl]amino]ethyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[2-[[7-chloranyl-2-(phenylmethyl)quinazolin-4-yl]amino]ethyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[2-[(2-benzyl-7-chloro-quinazolin-4-yl)amino]ethyl]-4-fluoro-benzenesulfonamide CAS Name: N-[2-[[7-chloro-2-(phenylmethyl)-4-quinazolinyl]amino]ethyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[2-[(2-benzyl-7-chloroquinazolin-4-yl)amino]ethyl]-4-fluorobenzenesulfonamide Traditional Name: N-[2-[(2-benzyl-7-chloro-quinazolin-4-yl)amino]ethyl]-4-fluoro-benzenesulfonamide Formula: C23H20ClFN4O2S MolecularWeight: 470.946903

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC3=C(C=CC(=C3)Cl)C(=N2)NCCNS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC3=C(C=CC(=C3)Cl)C(=N2)NCCNS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H20ClFN4O2S/c24-17-6-11-20-21(15-17)28-22(14-16-4-2-1-3-5-16)29-23(20)26-12-13-27-32(30,31)19-9-7-18(25)8-10-19/h1-11,15,27H,12-14H2,(H,26,28,29)