2-(methoxymethyl)-N-(6-methylsulfonylpyridin-3-yl)-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine

Systemtic Name: 2-(methoxymethyl)-N-(6-methylsulfonylpyridin-3-yl)-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine Openeye Name: 2-(methoxymethyl)-N-(6-methylsulfonyl-3-pyridyl)-7-[3-(trifluoromethyl)-2-pyridyl]quinazolin-4-amine CAS Name: 2-(methoxymethyl)-N-(6-methylsulfonyl-3-pyridinyl)-7-[3-(trifluoromethyl)-2-pyridinyl]-4-quinazolinamine IUPAC Name: 2-(methoxymethyl)-N-(6-methylsulfonylpyridin-3-yl)-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine Traditional Name: (6-mesyl-3-pyridyl)-[2-(methoxymethyl)-7-[3-(trifluoromethyl)-2-pyridyl]quinazolin-4-yl]amine Formula: C22H18F3N5O3S MolecularWeight: 489.47023

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=NC2=C(C=CC(=C2)C3=C(C=CC=N3)C(F)(F)F)C(=N1)NC4=CN=C(C=C4)S(=O)(=O)C

Isomeric SMILES

COCC1=NC2=C(C=CC(=C2)C3=C(C=CC=N3)C(F)(F)F)C(=N1)NC4=CN=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C22H18F3N5O3S/c1-33-12-18-29-17-10-13(20-16(22(23,24)25)4-3-9-26-20)5-7-15(17)21(30-18)28-14-6-8-19(27-11-14)34(2,31)32/h3-11H,12H2,1-2H3,(H,28,29,30)