1-phenethyl-3-[4,4,4-tris(fluoranyl)-3-(1-methylimidazol-2-yl)-3-oxidanyl-butyl]urea

Systemtic Name: 1-phenethyl-3-[4,4,4-tris(fluoranyl)-3-(1-methylimidazol-2-yl)-3-oxidanyl-butyl]urea Openeye Name: 1-phenethyl-3-[4,4,4-trifluoro-3-hydroxy-3-(1-methylimidazol-2-yl)butyl]urea CAS Name: 1-phenethyl-3-[4,4,4-trifluoro-3-hydroxy-3-(1-methyl-2-imidazolyl)butyl]urea IUPAC Name: 1-phenethyl-3-[4,4,4-trifluoro-3-hydroxy-3-(1-methylimidazol-2-yl)butyl]urea Traditional Name: 1-phenethyl-3-[4,4,4-trifluoro-3-hydroxy-3-(1-methylimidazol-2-yl)butyl]urea Formula: C17H21F3N4O2 MolecularWeight: 370.36945

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(CCNC(=O)NCCC2=CC=CC=C2)(C(F)(F)F)O

Isomeric SMILES

CN1C=CN=C1C(CCNC(=O)NCCC2=CC=CC=C2)(C(F)(F)F)O

InChI

InChI=1S/C17H21F3N4O2/c1-24-12-11-21-14(24)16(26,17(18,19)20)8-10-23-15(25)22-9-7-13-5-3-2-4-6-13/h2-6,11-12,26H,7-10H2,1H3,(H2,22,23,25)