N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-2-(trifluoromethyl)quinazolin-4-amine

Systemtic Name: N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-2-(trifluoromethyl)quinazolin-4-amine Openeye Name: N-[1-(p-tolylsulfonyl)-4-piperidyl]-2-(trifluoromethyl)quinazolin-4-amine CAS Name: N-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-2-(trifluoromethyl)-4-quinazolinamine IUPAC Name: N-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-2-(trifluoromethyl)quinazolin-4-amine Traditional Name: (1-tosyl-4-piperidyl)-[2-(trifluoromethyl)quinazolin-4-yl]amine Formula: C21H21F3N4O2S MolecularWeight: 450.47725

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC3=NC(=NC4=CC=CC=C43)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC3=NC(=NC4=CC=CC=C43)C(F)(F)F

InChI

InChI=1S/C21H21F3N4O2S/c1-14-6-8-16(9-7-14)31(29,30)28-12-10-15(11-13-28)25-19-17-4-2-3-5-18(17)26-20(27-19)21(22,23)24/h2-9,15H,10-13H2,1H3,(H,25,26,27)