N-butyl-N-[2-[[5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-3-fluoranyl-benzamide

Systemtic Name: N-butyl-N-[2-[[5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-3-fluoranyl-benzamide Openeye Name: N-butyl-N-[2-[[5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-3-fluoro-benzamide CAS Name: N-butyl-N-[2-[[5-tert-butyl-2-(4-chlorophenyl)-3-pyrazolyl]amino]-2-oxoethyl]-3-fluorobenzamide IUPAC Name: N-butyl-N-[2-[[5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl]amino]-2-oxoethyl]-3-fluorobenzamide Traditional Name: N-butyl-N-[2-[[5-tert-butyl-2-(4-chlorophenyl)pyrazol-3-yl]amino]-2-keto-ethyl]-3-fluoro-benzamide Formula: C26H30ClFN4O2 MolecularWeight: 484.993403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)Cl)C(C)(C)C)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)Cl)C(C)(C)C)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C26H30ClFN4O2/c1-5-6-14-31(25(34)18-8-7-9-20(28)15-18)17-24(33)29-23-16-22(26(2,3)4)30-32(23)21-12-10-19(27)11-13-21/h7-13,15-16H,5-6,14,17H2,1-4H3,(H,29,33)