1-(4-butyl-2-methyl-phenyl)-3-[2-[3-(trifluoromethyl)phenyl]ethyl]urea

Systemtic Name: 1-(4-butyl-2-methyl-phenyl)-3-[2-[3-(trifluoromethyl)phenyl]ethyl]urea Openeye Name: 1-(4-butyl-2-methyl-phenyl)-3-[2-[3-(trifluoromethyl)phenyl]ethyl]urea CAS Name: 1-(4-butyl-2-methylphenyl)-3-[2-[3-(trifluoromethyl)phenyl]ethyl]urea IUPAC Name: 1-(4-butyl-2-methylphenyl)-3-[2-[3-(trifluoromethyl)phenyl]ethyl]urea Traditional Name: 1-(4-butyl-2-methyl-phenyl)-3-[2-[3-(trifluoromethyl)phenyl]ethyl]urea Formula: C21H25F3N2O MolecularWeight: 378.43121

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C(C=C1)NC(=O)NCCC2=CC(=CC=C2)C(F)(F)F)C

Isomeric SMILES

CCCCC1=CC(=C(C=C1)NC(=O)NCCC2=CC(=CC=C2)C(F)(F)F)C

InChI

InChI=1S/C21H25F3N2O/c1-3-4-6-16-9-10-19(15(2)13-16)26-20(27)25-12-11-17-7-5-8-18(14-17)21(22,23)24/h5,7-10,13-14H,3-4,6,11-12H2,1-2H3,(H2,25,26,27)