1-cyclohexyl-3-[4-[4-(trifluoromethyl)phenyl]sulfanyl-2,3-dihydro-1H-phenalen-2-yl]urea

Systemtic Name: 1-cyclohexyl-3-[4-[4-(trifluoromethyl)phenyl]sulfanyl-2,3-dihydro-1H-phenalen-2-yl]urea Openeye Name: 1-cyclohexyl-3-[4-[4-(trifluoromethyl)phenyl]sulfanyl-2,3-dihydro-1H-phenalen-2-yl]urea CAS Name: 1-cyclohexyl-3-[4-[[4-(trifluoromethyl)phenyl]thio]-2,3-dihydro-1H-phenalen-2-yl]urea IUPAC Name: 1-cyclohexyl-3-[4-[4-(trifluoromethyl)phenyl]sulfanyl-2,3-dihydro-1H-phenalen-2-yl]urea Traditional Name: 1-cyclohexyl-3-[4-[[4-(trifluoromethyl)phenyl]thio]-2,3-dihydro-1H-phenalen-2-yl]urea Formula: C27H27F3N2OS MolecularWeight: 484.57629

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC2CC3=CC=CC4=C3C(=C(C=C4)SC5=CC=C(C=C5)C(F)(F)F)C2

Isomeric SMILES

C1CCC(CC1)NC(=O)NC2CC3=CC=CC4=C3C(=C(C=C4)SC5=CC=C(C=C5)C(F)(F)F)C2

InChI

InChI=1S/C27H27F3N2OS/c28-27(29,30)19-10-12-22(13-11-19)34-24-14-9-17-5-4-6-18-15-21(16-23(24)25(17)18)32-26(33)31-20-7-2-1-3-8-20/h4-6,9-14,20-21H,1-3,7-8,15-16H2,(H2,31,32,33)