N-[2-[1-(4-tert-butylphenyl)carbonylpiperidin-4-yl]pyrazol-3-yl]-3-fluoranyl-benzamide

Systemtic Name: N-[2-[1-(4-tert-butylphenyl)carbonylpiperidin-4-yl]pyrazol-3-yl]-3-fluoranyl-benzamide Openeye Name: N-[2-[1-(4-tert-butylbenzoyl)-4-piperidyl]pyrazol-3-yl]-3-fluoro-benzamide CAS Name: N-[2-[1-[(4-tert-butylphenyl)-oxomethyl]-4-piperidinyl]-3-pyrazolyl]-3-fluorobenzamide IUPAC Name: N-[2-[1-(4-tert-butylbenzoyl)piperidin-4-yl]pyrazol-3-yl]-3-fluorobenzamide Traditional Name: N-[2-[1-(4-tert-butylbenzoyl)-4-piperidyl]pyrazol-3-yl]-3-fluoro-benzamide Formula: C26H29FN4O2 MolecularWeight: 448.532463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC(=CC=C4)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)N2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C26H29FN4O2/c1-26(2,3)20-9-7-18(8-10-20)25(33)30-15-12-22(13-16-30)31-23(11-14-28-31)29-24(32)19-5-4-6-21(27)17-19/h4-11,14,17,22H,12-13,15-16H2,1-3H3,(H,29,32)