1-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-4-(2-dimethylaminoethyloxy)phenyl]-3-(4-fluoranyl-2-oxidanyl-phenyl)urea

Systemtic Name: 1-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-4-(2-dimethylaminoethyloxy)phenyl]-3-(4-fluoranyl-2-oxidanyl-phenyl)urea Openeye Name: 1-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-(2-dimethylaminoethyloxy)phenyl]-3-(4-fluoro-2-hydroxy-phenyl)urea CAS Name: 1-[3-(4-bromo-2-methyl-3-pyrazolyl)-4-(2-dimethylaminoethyloxy)phenyl]-3-(4-fluoro-2-hydroxyphenyl)urea IUPAC Name: 1-[3-(4-bromo-2-methylpyrazol-3-yl)-4-(2-dimethylaminoethyloxy)phenyl]-3-(4-fluoro-2-hydroxyphenyl)urea Traditional Name: 1-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-(2-dimethylaminoethyloxy)phenyl]-3-(4-fluoro-2-hydroxy-phenyl)urea Formula: C21H23BrFN5O3 MolecularWeight: 492.341423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23BrFN5O3/c1-27(2)8-9-31-19-7-5-14(11-15(19)20-16(22)12-24-28(20)3)25-21(30)26-17-6-4-13(23)10-18(17)29/h4-7,10-12,29H,8-9H2,1-3H3,(H2,25,26,30)