1-[[5-[(4-ethylsulfonylpiperazin-1-yl)methyl]-2-fluoranyl-phenyl]methyl]-3-(6-methoxypyridin-3-yl)urea

Systemtic Name: 1-[[5-[(4-ethylsulfonylpiperazin-1-yl)methyl]-2-fluoranyl-phenyl]methyl]-3-(6-methoxypyridin-3-yl)urea Openeye Name: 1-[[5-[(4-ethylsulfonylpiperazin-1-yl)methyl]-2-fluoro-phenyl]methyl]-3-(6-methoxy-3-pyridyl)urea CAS Name: 1-[[5-[(4-ethylsulfonyl-1-piperazinyl)methyl]-2-fluorophenyl]methyl]-3-(6-methoxy-3-pyridinyl)urea IUPAC Name: 1-[[5-[(4-ethylsulfonylpiperazin-1-yl)methyl]-2-fluorophenyl]methyl]-3-(6-methoxypyridin-3-yl)urea Traditional Name: 1-[5-[(4-esylpiperazino)methyl]-2-fluoro-benzyl]-3-(6-methoxy-3-pyridyl)urea Formula: C21H28FN5O4S MolecularWeight: 465.541523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)CC2=CC(=C(C=C2)F)CNC(=O)NC3=CN=C(C=C3)OC

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)CC2=CC(=C(C=C2)F)CNC(=O)NC3=CN=C(C=C3)OC

InChI

InChI=1S/C21H28FN5O4S/c1-3-32(29,30)27-10-8-26(9-11-27)15-16-4-6-19(22)17(12-16)13-24-21(28)25-18-5-7-20(31-2)23-14-18/h4-7,12,14H,3,8-11,13,15H2,1-2H3,(H2,24,25,28)