1-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-5-morpholin-4-yl-phenyl]-3-(4-fluorophenyl)urea

Systemtic Name: 1-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-5-morpholin-4-yl-phenyl]-3-(4-fluorophenyl)urea Openeye Name: 1-[3-(4-bromo-2-methyl-pyrazol-3-yl)-5-morpholino-phenyl]-3-(4-fluorophenyl)urea CAS Name: 1-[3-(4-bromo-2-methyl-3-pyrazolyl)-5-(4-morpholinyl)phenyl]-3-(4-fluorophenyl)urea IUPAC Name: 1-[3-(4-bromo-2-methylpyrazol-3-yl)-5-morpholin-4-ylphenyl]-3-(4-fluorophenyl)urea Traditional Name: 1-[3-(4-bromo-2-methyl-pyrazol-3-yl)-5-morpholino-phenyl]-3-(4-fluorophenyl)urea Formula: C21H21BrFN5O2 MolecularWeight: 474.326143

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C2=CC(=CC(=C2)NC(=O)NC3=CC=C(C=C3)F)N4CCOCC4

Isomeric SMILES

CN1C(=C(C=N1)Br)C2=CC(=CC(=C2)NC(=O)NC3=CC=C(C=C3)F)N4CCOCC4

InChI

InChI=1S/C21H21BrFN5O2/c1-27-20(19(22)13-24-27)14-10-17(12-18(11-14)28-6-8-30-9-7-28)26-21(29)25-16-4-2-15(23)3-5-16/h2-5,10-13H,6-9H2,1H3,(H2,25,26,29)