1-(4-tert-butylphenyl)-3-[4-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]phenyl]urea

Systemtic Name: 1-(4-tert-butylphenyl)-3-[4-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]phenyl]urea Openeye Name: 1-(4-tert-butylphenyl)-3-[4-[[4-(2-furylmethyl)piperazin-1-yl]methyl]phenyl]urea CAS Name: 1-(4-tert-butylphenyl)-3-[4-[[4-(2-furanylmethyl)-1-piperazinyl]methyl]phenyl]urea IUPAC Name: 1-(4-tert-butylphenyl)-3-[4-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]phenyl]urea Traditional Name: 1-(4-tert-butylphenyl)-3-[4-[[4-(2-furfuryl)piperazino]methyl]phenyl]urea Formula: C27H34N4O2 MolecularWeight: 446.58446

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)CC4=CC=CO4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)CN3CCN(CC3)CC4=CC=CO4

InChI

InChI=1S/C27H34N4O2/c1-27(2,3)22-8-12-24(13-9-22)29-26(32)28-23-10-6-21(7-11-23)19-30-14-16-31(17-15-30)20-25-5-4-18-33-25/h4-13,18H,14-17,19-20H2,1-3H3,(H2,28,29,32)