1-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]-3-[3-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-[4-[4-(4-tert-butylphenyl)carbonylpiperazin-1-yl]phenyl]-3-[3-(trifluoromethyl)phenyl]urea Openeye Name: 1-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]-3-[3-(trifluoromethyl)phenyl]urea CAS Name: 1-[4-[4-[(4-tert-butylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-3-[3-(trifluoromethyl)phenyl]urea IUPAC Name: 1-[4-[4-(4-tert-butylbenzoyl)piperazin-1-yl]phenyl]-3-[3-(trifluoromethyl)phenyl]urea Traditional Name: 1-[4-[4-(4-tert-butylbenzoyl)piperazino]phenyl]-3-[3-(trifluoromethyl)phenyl]urea Formula: C29H31F3N4O2 MolecularWeight: 524.57725

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C29H31F3N4O2/c1-28(2,3)21-9-7-20(8-10-21)26(37)36-17-15-35(16-18-36)25-13-11-23(12-14-25)33-27(38)34-24-6-4-5-22(19-24)29(30,31)32/h4-14,19H,15-18H2,1-3H3,(H2,33,34,38)