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

Systemtic Name: N-[4-[4-(2-bromophenyl)piperazin-1-yl]sulfonylphenyl]-7-chloranyl-quinolin-4-amine Openeye Name: N-[4-[4-(2-bromophenyl)piperazin-1-yl]sulfonylphenyl]-7-chloro-quinolin-4-amine CAS Name: N-[4-[[4-(2-bromophenyl)-1-piperazinyl]sulfonyl]phenyl]-7-chloro-4-quinolinamine IUPAC Name: N-[4-[4-(2-bromophenyl)piperazin-1-yl]sulfonylphenyl]-7-chloroquinolin-4-amine Traditional Name: [4-[4-(2-bromophenyl)piperazino]sulfonylphenyl]-(7-chloro-4-quinolyl)amine Formula: C25H22BrClN4O2S MolecularWeight: 557.88978

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C25H22BrClN4O2S/c26-22-3-1-2-4-25(22)30-13-15-31(16-14-30)34(32,33)20-8-6-19(7-9-20)29-23-11-12-28-24-17-18(27)5-10-21(23)24/h1-12,17H,13-16H2,(H,28,29)