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

Systemtic Name: N-(4-propylsulfonylphenyl)-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine Openeye Name: N-(4-propylsulfonylphenyl)-7-[3-(trifluoromethyl)-2-pyridyl]quinazolin-4-amine CAS Name: N-(4-propylsulfonylphenyl)-7-[3-(trifluoromethyl)-2-pyridinyl]-4-quinazolinamine IUPAC Name: N-(4-propylsulfonylphenyl)-7-[3-(trifluoromethyl)pyridin-2-yl]quinazolin-4-amine Traditional Name: (4-propylsulfonylphenyl)-[7-[3-(trifluoromethyl)-2-pyridyl]quinazolin-4-yl]amine Formula: C23H19F3N4O2S MolecularWeight: 472.48277

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCS(=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/C23H19F3N4O2S/c1-2-12-33(31,32)17-8-6-16(7-9-17)30-22-18-10-5-15(13-20(18)28-14-29-22)21-19(23(24,25)26)4-3-11-27-21/h3-11,13-14H,2,12H2,1H3,(H,28,29,30)