1-tert-butyl-3-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]urea

Systemtic Name: 1-tert-butyl-3-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]urea Openeye Name: 1-tert-butyl-3-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]urea CAS Name: 1-tert-butyl-3-[3-[4-(2-fluorophenyl)-1-piperazinyl]propyl]urea IUPAC Name: 1-tert-butyl-3-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]urea Traditional Name: 1-tert-butyl-3-[3-[4-(2-fluorophenyl)piperazino]propyl]urea Formula: C18H29FN4O MolecularWeight: 336.447463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NCCCN1CCN(CC1)C2=CC=CC=C2F

Isomeric SMILES

CC(C)(C)NC(=O)NCCCN1CCN(CC1)C2=CC=CC=C2F

InChI

InChI=1S/C18H29FN4O/c1-18(2,3)21-17(24)20-9-6-10-22-11-13-23(14-12-22)16-8-5-4-7-15(16)19/h4-5,7-8H,6,9-14H2,1-3H3,(H2,20,21,24)