N-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-4-methoxy-phenyl]-2-[2-(2-fluorophenyl)ethylamino]ethanamide

Systemtic Name: N-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-4-methoxy-phenyl]-2-[2-(2-fluorophenyl)ethylamino]ethanamide Openeye Name: N-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-methoxy-phenyl]-2-[2-(2-fluorophenyl)ethylamino]acetamide CAS Name: N-[3-(4-bromo-2-methyl-3-pyrazolyl)-4-methoxyphenyl]-2-[2-(2-fluorophenyl)ethylamino]acetamide IUPAC Name: N-[3-(4-bromo-2-methylpyrazol-3-yl)-4-methoxyphenyl]-2-[2-(2-fluorophenyl)ethylamino]acetamide Traditional Name: N-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-methoxy-phenyl]-2-[2-(2-fluorophenyl)ethylamino]acetamide Formula: C21H22BrFN4O2 MolecularWeight: 461.327383

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)Br)C2=C(C=CC(=C2)NC(=O)CNCCC3=CC=CC=C3F)OC

Isomeric SMILES

CN1C(=C(C=N1)Br)C2=C(C=CC(=C2)NC(=O)CNCCC3=CC=CC=C3F)OC

InChI

InChI=1S/C21H22BrFN4O2/c1-27-21(17(22)12-25-27)16-11-15(7-8-19(16)29-2)26-20(28)13-24-10-9-14-5-3-4-6-18(14)23/h3-8,11-12,24H,9-10,13H2,1-2H3,(H,26,28)