1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-[4-(3,5-dimethoxyphenyl)piperazin-1-yl]-2-phenyl-ethyl]urea

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-[4-(3,5-dimethoxyphenyl)piperazin-1-yl]-2-phenyl-ethyl]urea Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-[4-(3,5-dimethoxyphenyl)piperazin-1-yl]-2-phenyl-ethyl]urea CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-[4-(3,5-dimethoxyphenyl)-1-piperazinyl]-2-phenylethyl]urea IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-[4-(3,5-dimethoxyphenyl)piperazin-1-yl]-2-phenylethyl]urea Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[2-[4-(3,5-dimethoxyphenyl)piperazino]-2-phenyl-ethyl]urea Formula: C29H30F6N4O3 MolecularWeight: 596.563919

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2CCN(CC2)C(CNC(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)N2CCN(CC2)C(CNC(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=CC=CC=C4)OC

InChI

InChI=1S/C29H30F6N4O3/c1-41-24-15-23(16-25(17-24)42-2)38-8-10-39(11-9-38)26(19-6-4-3-5-7-19)18-36-27(40)37-22-13-20(28(30,31)32)12-21(14-22)29(33,34)35/h3-7,12-17,26H,8-11,18H2,1-2H3,(H2,36,37,40)