1-(4-tert-butylphenyl)-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]urea

Systemtic Name: 1-(4-tert-butylphenyl)-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]urea Openeye Name: 1-(4-tert-butylphenyl)-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]urea CAS Name: 1-(4-tert-butylphenyl)-3-[4-[(4-methyl-1-piperazinyl)methyl]phenyl]urea IUPAC Name: 1-(4-tert-butylphenyl)-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]urea Traditional Name: 1-(4-tert-butylphenyl)-3-[4-[(4-methylpiperazino)methyl]phenyl]urea Formula: C23H32N4O MolecularWeight: 380.52638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)CN3CCN(CC3)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)CN3CCN(CC3)C

InChI

InChI=1S/C23H32N4O/c1-23(2,3)19-7-11-21(12-8-19)25-22(28)24-20-9-5-18(6-10-20)17-27-15-13-26(4)14-16-27/h5-12H,13-17H2,1-4H3,(H2,24,25,28)