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

Systemtic Name: N-[4-[4-(2-bromophenyl)piperazin-1-yl]sulfonylphenyl]-7-(trifluoromethyl)quinolin-4-amine Openeye Name: N-[4-[4-(2-bromophenyl)piperazin-1-yl]sulfonylphenyl]-7-(trifluoromethyl)quinolin-4-amine CAS Name: N-[4-[[4-(2-bromophenyl)-1-piperazinyl]sulfonyl]phenyl]-7-(trifluoromethyl)-4-quinolinamine IUPAC Name: N-[4-[4-(2-bromophenyl)piperazin-1-yl]sulfonylphenyl]-7-(trifluoromethyl)quinolin-4-amine Traditional Name: [4-[4-(2-bromophenyl)piperazino]sulfonylphenyl]-[7-(trifluoromethyl)-4-quinolyl]amine Formula: C26H22BrF3N4O2S MolecularWeight: 591.44269

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2Br)S(=O)(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2Br)S(=O)(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)C(F)(F)F

InChI

InChI=1S/C26H22BrF3N4O2S/c27-22-3-1-2-4-25(22)33-13-15-34(16-14-33)37(35,36)20-8-6-19(7-9-20)32-23-11-12-31-24-17-18(26(28,29)30)5-10-21(23)24/h1-12,17H,13-16H2,(H,31,32)