6-(2-fluoranyl-6-methylsulfonyl-phenoxy)quinazolin-4-amine; 1H-pyrazole

Systemtic Name: 6-(2-fluoranyl-6-methylsulfonyl-phenoxy)quinazolin-4-amine; 1H-pyrazole Openeye Name: 6-(2-fluoro-6-methylsulfonyl-phenoxy)quinazolin-4-amine; 1H-pyrazole CAS Name: 6-(2-fluoro-6-methylsulfonylphenoxy)-4-quinazolinamine; 1H-pyrazole IUPAC Name: 6-(2-fluoro-6-methylsulfonylphenoxy)quinazolin-4-amine; 1H-pyrazole Traditional Name: [6-(2-fluoro-6-mesyl-phenoxy)quinazolin-4-yl]amine; 1H-pyrazole Formula: C18H16FN5O3S MolecularWeight: 401.414743

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1OC2=CC3=C(C=C2)N=CN=C3N)F.C1=CNN=C1

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1OC2=CC3=C(C=C2)N=CN=C3N)F.C1=CNN=C1

InChI

InChI=1S/C15H12FN3O3S.C3H4N2/c1-23(20,21)13-4-2-3-11(16)14(13)22-9-5-6-12-10(7-9)15(17)19-8-18-12;1-2-4-5-3-1/h2-8H,1H3,(H2,17,18,19);1-3H,(H,4,5)