1-[1-[3-(4-ethylsulfonylpiperazin-1-yl)-5-fluoranyl-phenyl]propyl]-3-(6-methylpyridin-3-yl)urea

Systemtic Name: 1-[1-[3-(4-ethylsulfonylpiperazin-1-yl)-5-fluoranyl-phenyl]propyl]-3-(6-methylpyridin-3-yl)urea Openeye Name: 1-[1-[3-(4-ethylsulfonylpiperazin-1-yl)-5-fluoro-phenyl]propyl]-3-(6-methyl-3-pyridyl)urea CAS Name: 1-[1-[3-(4-ethylsulfonyl-1-piperazinyl)-5-fluorophenyl]propyl]-3-(6-methyl-3-pyridinyl)urea IUPAC Name: 1-[1-[3-(4-ethylsulfonylpiperazin-1-yl)-5-fluorophenyl]propyl]-3-(6-methylpyridin-3-yl)urea Traditional Name: 1-[1-[3-(4-esylpiperazino)-5-fluoro-phenyl]propyl]-3-(6-methyl-3-pyridyl)urea Formula: C22H30FN5O3S MolecularWeight: 463.568703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC(=C1)F)N2CCN(CC2)S(=O)(=O)CC)NC(=O)NC3=CN=C(C=C3)C

Isomeric SMILES

CCC(C1=CC(=CC(=C1)F)N2CCN(CC2)S(=O)(=O)CC)NC(=O)NC3=CN=C(C=C3)C

InChI

InChI=1S/C22H30FN5O3S/c1-4-21(26-22(29)25-19-7-6-16(3)24-15-19)17-12-18(23)14-20(13-17)27-8-10-28(11-9-27)32(30,31)5-2/h6-7,12-15,21H,4-5,8-11H2,1-3H3,(H2,25,26,29)