2,5-bis(bromanyl)-3,6-bis(fluoranyl)-N-(4-methoxy-3-piperazin-1-yl-phenyl)benzenesulfonamide

Systemtic Name: 2,5-bis(bromanyl)-3,6-bis(fluoranyl)-N-(4-methoxy-3-piperazin-1-yl-phenyl)benzenesulfonamide Openeye Name: 2,5-dibromo-3,6-difluoro-N-(4-methoxy-3-piperazin-1-yl-phenyl)benzenesulfonamide CAS Name: 2,5-dibromo-3,6-difluoro-N-[4-methoxy-3-(1-piperazinyl)phenyl]benzenesulfonamide IUPAC Name: 2,5-dibromo-3,6-difluoro-N-(4-methoxy-3-piperazin-1-ylphenyl)benzenesulfonamide Traditional Name: 2,5-dibromo-3,6-difluoro-N-(4-methoxy-3-piperazino-phenyl)benzenesulfonamide Formula: C17H17Br2F2N3O3S MolecularWeight: 541.204986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NS(=O)(=O)C2=C(C(=CC(=C2F)Br)F)Br)N3CCNCC3

Isomeric SMILES

COC1=C(C=C(C=C1)NS(=O)(=O)C2=C(C(=CC(=C2F)Br)F)Br)N3CCNCC3

InChI

InChI=1S/C17H17Br2F2N3O3S/c1-27-14-3-2-10(8-13(14)24-6-4-22-5-7-24)23-28(25,26)17-15(19)12(20)9-11(18)16(17)21/h2-3,8-9,22-23H,4-7H2,1H3