1-(2-bromanyl-4-fluoranyl-phenyl)-4-cyano-5-(4-methoxyphenyl)-N-piperidin-1-yl-pyrazole-3-carboxamide

Systemtic Name: 1-(2-bromanyl-4-fluoranyl-phenyl)-4-cyano-5-(4-methoxyphenyl)-N-piperidin-1-yl-pyrazole-3-carboxamide Openeye Name: 1-(2-bromo-4-fluoro-phenyl)-4-cyano-5-(4-methoxyphenyl)-N-(1-piperidyl)pyrazole-3-carboxamide CAS Name: 1-(2-bromo-4-fluorophenyl)-4-cyano-5-(4-methoxyphenyl)-N-(1-piperidinyl)-3-pyrazolecarboxamide IUPAC Name: 1-(2-bromo-4-fluorophenyl)-4-cyano-5-(4-methoxyphenyl)-N-piperidin-1-ylpyrazole-3-carboxamide Traditional Name: 1-(2-bromo-4-fluoro-phenyl)-4-cyano-5-(4-methoxyphenyl)-N-piperidino-pyrazole-3-carboxamide Formula: C23H21BrFN5O2 MolecularWeight: 498.347543

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=NN2C3=C(C=C(C=C3)F)Br)C(=O)NN4CCCCC4)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=NN2C3=C(C=C(C=C3)F)Br)C(=O)NN4CCCCC4)C#N

InChI

InChI=1S/C23H21BrFN5O2/c1-32-17-8-5-15(6-9-17)22-18(14-26)21(23(31)28-29-11-3-2-4-12-29)27-30(22)20-10-7-16(25)13-19(20)24/h5-10,13H,2-4,11-12H2,1H3,(H,28,31)