1-[4-[4-[5-azanyl-6-[1-[2,6-bis(chloranyl)-3-fluoranyl-phenyl]ethoxy]pyrazin-2-yl]pyrazol-1-yl]piperidin-1-yl]-2-oxidanyl-ethanone

Systemtic Name: 1-[4-[4-[5-azanyl-6-[1-[2,6-bis(chloranyl)-3-fluoranyl-phenyl]ethoxy]pyrazin-2-yl]pyrazol-1-yl]piperidin-1-yl]-2-oxidanyl-ethanone Openeye Name: 1-[4-[4-[5-amino-6-[1-(2,6-dichloro-3-fluoro-phenyl)ethoxy]pyrazin-2-yl]pyrazol-1-yl]-1-piperidyl]-2-hydroxy-ethanone CAS Name: 1-[4-[4-[5-amino-6-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-2-pyrazinyl]-1-pyrazolyl]-1-piperidinyl]-2-hydroxyethanone IUPAC Name: 1-[4-[4-[5-amino-6-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyrazin-2-yl]pyrazol-1-yl]piperidin-1-yl]-2-hydroxyethanone Traditional Name: 1-[4-[4-[5-amino-6-[1-(2,6-dichloro-3-fluoro-phenyl)ethoxy]pyrazin-2-yl]pyrazol-1-yl]piperidino]-2-hydroxy-ethanone Formula: C22H23Cl2FN6O3 MolecularWeight: 509.360823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1Cl)F)Cl)OC2=NC(=CN=C2N)C3=CN(N=C3)C4CCN(CC4)C(=O)CO

Isomeric SMILES

CC(C1=C(C=CC(=C1Cl)F)Cl)OC2=NC(=CN=C2N)C3=CN(N=C3)C4CCN(CC4)C(=O)CO

InChI

InChI=1S/C22H23Cl2FN6O3/c1-12(19-15(23)2-3-16(25)20(19)24)34-22-21(26)27-9-17(29-22)13-8-28-31(10-13)14-4-6-30(7-5-14)18(33)11-32/h2-3,8-10,12,14,32H,4-7,11H2,1H3,(H2,26,27)