1-[4-methoxy-2-(trifluoromethyl)phenyl]-3-[2-(2-oxidanylidenepyrrolidin-1-yl)-1-phenyl-ethyl]urea

Systemtic Name: 1-[4-methoxy-2-(trifluoromethyl)phenyl]-3-[2-(2-oxidanylidenepyrrolidin-1-yl)-1-phenyl-ethyl]urea Openeye Name: 1-[4-methoxy-2-(trifluoromethyl)phenyl]-3-[2-(2-oxopyrrolidin-1-yl)-1-phenyl-ethyl]urea CAS Name: 1-[4-methoxy-2-(trifluoromethyl)phenyl]-3-[2-(2-oxo-1-pyrrolidinyl)-1-phenylethyl]urea IUPAC Name: 1-[4-methoxy-2-(trifluoromethyl)phenyl]-3-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]urea Traditional Name: 1-[2-(2-ketopyrrolidino)-1-phenyl-ethyl]-3-[4-methoxy-2-(trifluoromethyl)phenyl]urea Formula: C21H22F3N3O3 MolecularWeight: 421.41289

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)NC(CN2CCCC2=O)C3=CC=CC=C3)C(F)(F)F

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)NC(CN2CCCC2=O)C3=CC=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H22F3N3O3/c1-30-15-9-10-17(16(12-15)21(22,23)24)25-20(29)26-18(14-6-3-2-4-7-14)13-27-11-5-8-19(27)28/h2-4,6-7,9-10,12,18H,5,8,11,13H2,1H3,(H2,25,26,29)