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

Systemtic Name: 1-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-4-phenethyloxy-phenyl]-3-(4-fluorophenyl)urea Openeye Name: 1-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-phenethyloxy-phenyl]-3-(4-fluorophenyl)urea CAS Name: 1-[3-(4-bromo-2-methyl-3-pyrazolyl)-4-phenethyloxyphenyl]-3-(4-fluorophenyl)urea IUPAC Name: 1-[3-(4-bromo-2-methylpyrazol-3-yl)-4-phenethyloxyphenyl]-3-(4-fluorophenyl)urea Traditional Name: 1-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-phenethyloxy-phenyl]-3-(4-fluorophenyl)urea Formula: C25H22BrFN4O2 MolecularWeight: 509.370183

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)F)OCCC4=CC=CC=C4

Isomeric SMILES

CN1C(=C(C=N1)Br)C2=C(C=CC(=C2)NC(=O)NC3=CC=C(C=C3)F)OCCC4=CC=CC=C4

InChI

InChI=1S/C25H22BrFN4O2/c1-31-24(22(26)16-28-31)21-15-20(30-25(32)29-19-9-7-18(27)8-10-19)11-12-23(21)33-14-13-17-5-3-2-4-6-17/h2-12,15-16H,13-14H2,1H3,(H2,29,30,32)