N-[5-azanyl-1-[2,5-bis(fluoranyl)phenyl]-3-tert-butyl-pyrazol-4-yl]-4-methyl-piperidine-1-carboxamide

Systemtic Name: N-[5-azanyl-1-[2,5-bis(fluoranyl)phenyl]-3-tert-butyl-pyrazol-4-yl]-4-methyl-piperidine-1-carboxamide Openeye Name: N-[5-amino-3-tert-butyl-1-(2,5-difluorophenyl)pyrazol-4-yl]-4-methyl-piperidine-1-carboxamide CAS Name: N-[5-amino-3-tert-butyl-1-(2,5-difluorophenyl)-4-pyrazolyl]-4-methyl-1-piperidinecarboxamide IUPAC Name: N-[5-amino-3-tert-butyl-1-(2,5-difluorophenyl)pyrazol-4-yl]-4-methylpiperidine-1-carboxamide Traditional Name: N-[5-amino-3-tert-butyl-1-(2,5-difluorophenyl)pyrazol-4-yl]-4-methyl-piperidine-1-carboxamide Formula: C20H27F2N5O MolecularWeight: 391.458086

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)NC2=C(N(N=C2C(C)(C)C)C3=C(C=CC(=C3)F)F)N

Isomeric SMILES

CC1CCN(CC1)C(=O)NC2=C(N(N=C2C(C)(C)C)C3=C(C=CC(=C3)F)F)N

InChI

InChI=1S/C20H27F2N5O/c1-12-7-9-26(10-8-12)19(28)24-16-17(20(2,3)4)25-27(18(16)23)15-11-13(21)5-6-14(15)22/h5-6,11-12H,7-10,23H2,1-4H3,(H,24,28)