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

Systemtic Name: N-[4-[4-(4-bromanyl-2-propyl-phenyl)sulfonylpiperazin-1-yl]sulfonylphenyl]-7-chloranyl-quinolin-4-amine Openeye Name: N-[4-[4-(4-bromo-2-propyl-phenyl)sulfonylpiperazin-1-yl]sulfonylphenyl]-7-chloro-quinolin-4-amine CAS Name: N-[4-[[4-(4-bromo-2-propylphenyl)sulfonyl-1-piperazinyl]sulfonyl]phenyl]-7-chloro-4-quinolinamine IUPAC Name: N-[4-[4-(4-bromo-2-propylphenyl)sulfonylpiperazin-1-yl]sulfonylphenyl]-7-chloroquinolin-4-amine Traditional Name: [4-[4-(4-bromo-2-propyl-phenyl)sulfonylpiperazino]sulfonylphenyl]-(7-chloro-4-quinolyl)amine Formula: C28H28BrClN4O4S2 MolecularWeight: 664.03332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)Cl

Isomeric SMILES

CCCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC4=C5C=CC(=CC5=NC=C4)Cl

InChI

InChI=1S/C28H28BrClN4O4S2/c1-2-3-20-18-21(29)4-11-28(20)40(37,38)34-16-14-33(15-17-34)39(35,36)24-8-6-23(7-9-24)32-26-12-13-31-27-19-22(30)5-10-25(26)27/h4-13,18-19H,2-3,14-17H2,1H3,(H,31,32)