N-[3,4-bis(fluoranyl)-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]phenyl]-4-[2-(cyclobutylamino)ethyl]piperidine-1-sulfonamide

Systemtic Name: N-[3,4-bis(fluoranyl)-2-[(2-fluoranyl-4-iodanyl-phenyl)amino]phenyl]-4-[2-(cyclobutylamino)ethyl]piperidine-1-sulfonamide Openeye Name: 4-[2-(cyclobutylamino)ethyl]-N-[3,4-difluoro-2-(2-fluoro-4-iodo-anilino)phenyl]piperidine-1-sulfonamide CAS Name: 4-[2-(cyclobutylamino)ethyl]-N-[3,4-difluoro-2-(2-fluoro-4-iodoanilino)phenyl]-1-piperidinesulfonamide IUPAC Name: 4-[2-(cyclobutylamino)ethyl]-N-[3,4-difluoro-2-(2-fluoro-4-iodoanilino)phenyl]piperidine-1-sulfonamide Traditional Name: 4-[2-(cyclobutylamino)ethyl]-N-[3,4-difluoro-2-(2-fluoro-4-iodo-anilino)phenyl]piperidine-1-sulfonamide Formula: C23H28F3IN4O2S MolecularWeight: 608.4587

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)NCCC2CCN(CC2)S(=O)(=O)NC3=C(C(=C(C=C3)F)F)NC4=C(C=C(C=C4)I)F

Isomeric SMILES

C1CC(C1)NCCC2CCN(CC2)S(=O)(=O)NC3=C(C(=C(C=C3)F)F)NC4=C(C=C(C=C4)I)F

InChI

InChI=1S/C23H28F3IN4O2S/c24-18-5-7-21(23(22(18)26)29-20-6-4-16(27)14-19(20)25)30-34(32,33)31-12-9-15(10-13-31)8-11-28-17-2-1-3-17/h4-7,14-15,17,28-30H,1-3,8-13H2