N-[4-[4-(2-bromanyl-4-fluoranyl-phenyl)piperazin-1-yl]sulfonylphenyl]-7-chloranyl-quinolin-4-amine

Systemtic Name: N-[4-[4-(2-bromanyl-4-fluoranyl-phenyl)piperazin-1-yl]sulfonylphenyl]-7-chloranyl-quinolin-4-amine Openeye Name: N-[4-[4-(2-bromo-4-fluoro-phenyl)piperazin-1-yl]sulfonylphenyl]-7-chloro-quinolin-4-amine CAS Name: N-[4-[[4-(2-bromo-4-fluorophenyl)-1-piperazinyl]sulfonyl]phenyl]-7-chloro-4-quinolinamine IUPAC Name: N-[4-[4-(2-bromo-4-fluorophenyl)piperazin-1-yl]sulfonylphenyl]-7-chloroquinolin-4-amine Traditional Name: [4-[4-(2-bromo-4-fluoro-phenyl)piperazino]sulfonylphenyl]-(7-chloro-4-quinolyl)amine Formula: C25H21BrClFN4O2S MolecularWeight: 575.880243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)F)Br)S(=O)(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)F)Br)S(=O)(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)Cl

InChI

InChI=1S/C25H21BrClFN4O2S/c26-22-16-18(28)2-8-25(22)31-11-13-32(14-12-31)35(33,34)20-5-3-19(4-6-20)30-23-9-10-29-24-15-17(27)1-7-21(23)24/h1-10,15-16H,11-14H2,(H,29,30)