N-(4-methylsulfonylphenyl)-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine

Systemtic Name: N-(4-methylsulfonylphenyl)-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine Openeye Name: N-(4-methylsulfonylphenyl)-7-[3-(trifluoromethyl)-2-pyridyl]quinazolin-4-amine CAS Name: N-(4-methylsulfonylphenyl)-7-[3-(trifluoromethyl)-2-pyridinyl]-4-quinazolinamine IUPAC Name: N-(4-methylsulfonylphenyl)-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine Traditional Name: (4-mesylphenyl)-[7-[3-(trifluoromethyl)-2-pyridyl]quinazolin-4-yl]amine Formula: C21H15F3N4O2S MolecularWeight: 444.42961

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC2=NC=NC3=C2C=CC(=C3)C4=C(C=CC=N4)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC2=NC=NC3=C2C=CC(=C3)C4=C(C=CC=N4)C(F)(F)F

InChI

InChI=1S/C21H15F3N4O2S/c1-31(29,30)15-7-5-14(6-8-15)28-20-16-9-4-13(11-18(16)26-12-27-20)19-17(21(22,23)24)3-2-10-25-19/h2-12H,1H3,(H,26,27,28)