1-(4-tert-butylphenyl)-3-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-(4-tert-butylphenyl)-3-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]urea Openeye Name: 1-(4-tert-butylphenyl)-3-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]urea CAS Name: 1-(4-tert-butylphenyl)-3-[2-(1-pyrrolidinyl)-5-(trifluoromethyl)phenyl]urea IUPAC Name: 1-(4-tert-butylphenyl)-3-[2-pyrrolidin-1-yl-5-(trifluoromethyl)phenyl]urea Traditional Name: 1-(4-tert-butylphenyl)-3-[2-pyrrolidino-5-(trifluoromethyl)phenyl]urea Formula: C22H26F3N3O MolecularWeight: 405.45655

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCCC3

InChI

InChI=1S/C22H26F3N3O/c1-21(2,3)15-6-9-17(10-7-15)26-20(29)27-18-14-16(22(23,24)25)8-11-19(18)28-12-4-5-13-28/h6-11,14H,4-5,12-13H2,1-3H3,(H2,26,27,29)