1-(4-tert-butylphenyl)-3-[2-(4-tert-butylphenyl)-2-(4-cyclohexylpiperazin-1-yl)ethyl]urea

Systemtic Name: 1-(4-tert-butylphenyl)-3-[2-(4-tert-butylphenyl)-2-(4-cyclohexylpiperazin-1-yl)ethyl]urea Openeye Name: 1-(4-tert-butylphenyl)-3-[2-(4-tert-butylphenyl)-2-(4-cyclohexylpiperazin-1-yl)ethyl]urea CAS Name: 1-(4-tert-butylphenyl)-3-[2-(4-tert-butylphenyl)-2-(4-cyclohexyl-1-piperazinyl)ethyl]urea IUPAC Name: 1-(4-tert-butylphenyl)-3-[2-(4-tert-butylphenyl)-2-(4-cyclohexylpiperazin-1-yl)ethyl]urea Traditional Name: 1-(4-tert-butylphenyl)-3-[2-(4-tert-butylphenyl)-2-(4-cyclohexylpiperazino)ethyl]urea Formula: C33H50N4O MolecularWeight: 518.7763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(CNC(=O)NC2=CC=C(C=C2)C(C)(C)C)N3CCN(CC3)C4CCCCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(CNC(=O)NC2=CC=C(C=C2)C(C)(C)C)N3CCN(CC3)C4CCCCC4

InChI

InChI=1S/C33H50N4O/c1-32(2,3)26-14-12-25(13-15-26)30(37-22-20-36(21-23-37)29-10-8-7-9-11-29)24-34-31(38)35-28-18-16-27(17-19-28)33(4,5)6/h12-19,29-30H,7-11,20-24H2,1-6H3,(H2,34,35,38)