1-(2-methylphenyl)-3-[3-(4-methylpiperazin-1-yl)propyl]urea

Systemtic Name: 1-(2-methylphenyl)-3-[3-(4-methylpiperazin-1-yl)propyl]urea Openeye Name: 1-[3-(4-methylpiperazin-1-yl)propyl]-3-(o-tolyl)urea CAS Name: 1-(2-methylphenyl)-3-[3-(4-methyl-1-piperazinyl)propyl]urea IUPAC Name: 1-(2-methylphenyl)-3-[3-(4-methylpiperazin-1-yl)propyl]urea Traditional Name: 1-[3-(4-methylpiperazino)propyl]-3-(o-tolyl)urea Formula: C16H26N4O MolecularWeight: 290.40384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NCCCN2CCN(CC2)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NCCCN2CCN(CC2)C

InChI

InChI=1S/C16H26N4O/c1-14-6-3-4-7-15(14)18-16(21)17-8-5-9-20-12-10-19(2)11-13-20/h3-4,6-7H,5,8-13H2,1-2H3,(H2,17,18,21)