N-[4-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]sulfonylphenyl]-7-(trifluoromethyl)quinolin-4-amine

Systemtic Name: N-[4-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]sulfonylphenyl]-7-(trifluoromethyl)quinolin-4-amine Openeye Name: N-[4-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]sulfonylphenyl]-7-(trifluoromethyl)quinolin-4-amine CAS Name: N-[4-[[4-(4-methoxy-2-pyrimidinyl)-1-piperazinyl]sulfonyl]phenyl]-7-(trifluoromethyl)-4-quinolinamine IUPAC Name: N-[4-[4-(4-methoxypyrimidin-2-yl)piperazin-1-yl]sulfonylphenyl]-7-(trifluoromethyl)quinolin-4-amine Traditional Name: [4-[4-(4-methoxypyrimidin-2-yl)piperazino]sulfonylphenyl]-[7-(trifluoromethyl)-4-quinolyl]amine Formula: C25H23F3N6O3S MolecularWeight: 544.54873

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)C(F)(F)F

Isomeric SMILES

COC1=NC(=NC=C1)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)C(F)(F)F

InChI

InChI=1S/C25H23F3N6O3S/c1-37-23-9-11-30-24(32-23)33-12-14-34(15-13-33)38(35,36)19-5-3-18(4-6-19)31-21-8-10-29-22-16-17(25(26,27)28)2-7-20(21)22/h2-11,16H,12-15H2,1H3,(H,29,31)