N-[4,5-dimethoxy-2-(4-phenylpiperazin-1-yl)carbonyl-phenyl]-N-[(2-fluorophenyl)methyl]methanesulfonamide

Systemtic Name: N-[4,5-dimethoxy-2-(4-phenylpiperazin-1-yl)carbonyl-phenyl]-N-[(2-fluorophenyl)methyl]methanesulfonamide Openeye Name: N-[4,5-dimethoxy-2-(4-phenylpiperazine-1-carbonyl)phenyl]-N-[(2-fluorophenyl)methyl]methanesulfonamide CAS Name: N-[4,5-dimethoxy-2-[oxo-(4-phenyl-1-piperazinyl)methyl]phenyl]-N-[(2-fluorophenyl)methyl]methanesulfonamide IUPAC Name: N-[4,5-dimethoxy-2-(4-phenylpiperazine-1-carbonyl)phenyl]-N-[(2-fluorophenyl)methyl]methanesulfonamide Traditional Name: N-[4,5-dimethoxy-2-(4-phenylpiperazine-1-carbonyl)phenyl]-N-(2-fluorobenzyl)methanesulfonamide Formula: C27H30FN3O5S MolecularWeight: 527.607603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)N(CC4=CC=CC=C4F)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3)N(CC4=CC=CC=C4F)S(=O)(=O)C)OC

InChI

InChI=1S/C27H30FN3O5S/c1-35-25-17-22(27(32)30-15-13-29(14-16-30)21-10-5-4-6-11-21)24(18-26(25)36-2)31(37(3,33)34)19-20-9-7-8-12-23(20)28/h4-12,17-18H,13-16,19H2,1-3H3