1-(4-fluorophenyl)-3-[4-[4-(3-methylphenyl)piperazin-1-yl]butan-2-yl]urea

Systemtic Name: 1-(4-fluorophenyl)-3-[4-[4-(3-methylphenyl)piperazin-1-yl]butan-2-yl]urea Openeye Name: 1-(4-fluorophenyl)-3-[1-methyl-3-[4-(m-tolyl)piperazin-1-yl]propyl]urea CAS Name: 1-(4-fluorophenyl)-3-[4-[4-(3-methylphenyl)-1-piperazinyl]butan-2-yl]urea IUPAC Name: 1-(4-fluorophenyl)-3-[4-[4-(3-methylphenyl)piperazin-1-yl]butan-2-yl]urea Traditional Name: 1-(4-fluorophenyl)-3-[1-methyl-3-[4-(m-tolyl)piperazino]propyl]urea Formula: C22H29FN4O MolecularWeight: 384.490263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)CCC(C)NC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)CCC(C)NC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C22H29FN4O/c1-17-4-3-5-21(16-17)27-14-12-26(13-15-27)11-10-18(2)24-22(28)25-20-8-6-19(23)7-9-20/h3-9,16,18H,10-15H2,1-2H3,(H2,24,25,28)