6-(2-fluoranyl-6-methylsulfonyl-phenoxy)-N-(1H-pyrazol-5-yl)quinazolin-4-amine

Systemtic Name: 6-(2-fluoranyl-6-methylsulfonyl-phenoxy)-N-(1H-pyrazol-5-yl)quinazolin-4-amine Openeye Name: 6-(2-fluoro-6-methylsulfonyl-phenoxy)-N-(1H-pyrazol-5-yl)quinazolin-4-amine CAS Name: 6-(2-fluoro-6-methylsulfonylphenoxy)-N-(1H-pyrazol-5-yl)-4-quinazolinamine IUPAC Name: 6-(2-fluoro-6-methylsulfonylphenoxy)-N-(1H-pyrazol-5-yl)quinazolin-4-amine Traditional Name: [6-(2-fluoro-6-mesyl-phenoxy)quinazolin-4-yl]-(1H-pyrazol-5-yl)amine Formula: C18H14FN5O3S MolecularWeight: 399.398863

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1OC2=CC3=C(C=C2)N=CN=C3NC4=CC=NN4)F

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1OC2=CC3=C(C=C2)N=CN=C3NC4=CC=NN4)F

InChI

InChI=1S/C18H14FN5O3S/c1-28(25,26)15-4-2-3-13(19)17(15)27-11-5-6-14-12(9-11)18(21-10-20-14)23-16-7-8-22-24-16/h2-10H,1H3,(H2,20,21,22,23,24)