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

Systemtic Name: 1-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-5-pyrrolidin-1-yl-phenyl]-3-(4-fluorophenyl)urea Openeye Name: 1-[3-(4-bromo-2-methyl-pyrazol-3-yl)-5-pyrrolidin-1-yl-phenyl]-3-(4-fluorophenyl)urea CAS Name: 1-[3-(4-bromo-2-methyl-3-pyrazolyl)-5-(1-pyrrolidinyl)phenyl]-3-(4-fluorophenyl)urea IUPAC Name: 1-[3-(4-bromo-2-methylpyrazol-3-yl)-5-pyrrolidin-1-ylphenyl]-3-(4-fluorophenyl)urea Traditional Name: 1-[3-(4-bromo-2-methyl-pyrazol-3-yl)-5-pyrrolidino-phenyl]-3-(4-fluorophenyl)urea Formula: C21H21BrFN5O MolecularWeight: 458.326743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C2=CC(=CC(=C2)NC(=O)NC3=CC=C(C=C3)F)N4CCCC4

Isomeric SMILES

CN1C(=C(C=N1)Br)C2=CC(=CC(=C2)NC(=O)NC3=CC=C(C=C3)F)N4CCCC4

InChI

InChI=1S/C21H21BrFN5O/c1-27-20(19(22)13-24-27)14-10-17(12-18(11-14)28-8-2-3-9-28)26-21(29)25-16-6-4-15(23)5-7-16/h4-7,10-13H,2-3,8-9H2,1H3,(H2,25,26,29)