ethyl 2-azanyl-4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 2-azanyl-4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidine-1-carboxylate Openeye Name: ethyl 2-amino-4-[3-(4-fluorophenyl)-4-(4-pyridyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate CAS Name: 2-amino-4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-[3-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-5-yl]piperidine-1-carboxylate Traditional Name: 2-amino-4-[3-(4-fluorophenyl)-4-(4-pyridyl)-1H-pyrazol-5-yl]piperidine-1-carboxylic acid ethyl ester Formula: C22H24FN5O2 MolecularWeight: 409.456663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1N)C2=C(C(=NN2)C3=CC=C(C=C3)F)C4=CC=NC=C4

Isomeric SMILES

CCOC(=O)N1CCC(CC1N)C2=C(C(=NN2)C3=CC=C(C=C3)F)C4=CC=NC=C4

InChI

InChI=1S/C22H24FN5O2/c1-2-30-22(29)28-12-9-16(13-18(28)24)21-19(14-7-10-25-11-8-14)20(26-27-21)15-3-5-17(23)6-4-15/h3-8,10-11,16,18H,2,9,12-13,24H2,1H3,(H,26,27)