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

Systemtic Name: N-butyl-N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-2-fluoranyl-benzamide Openeye Name: N-butyl-N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-2-fluoro-benzamide CAS Name: N-butyl-N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)-3-pyrazolyl]amino]-2-oxoethyl]-2-fluorobenzamide IUPAC Name: N-butyl-N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-oxoethyl]-2-fluorobenzamide Traditional Name: N-butyl-N-[2-[[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]amino]-2-keto-ethyl]-2-fluoro-benzamide Formula: C27H33FN4O3 MolecularWeight: 480.574323

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)OC)C(C)(C)C)C(=O)C3=CC=CC=C3F

Isomeric SMILES

CCCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)OC)C(C)(C)C)C(=O)C3=CC=CC=C3F

InChI

InChI=1S/C27H33FN4O3/c1-6-7-16-31(26(34)21-10-8-9-11-22(21)28)18-25(33)29-24-17-23(27(2,3)4)30-32(24)19-12-14-20(35-5)15-13-19/h8-15,17H,6-7,16,18H2,1-5H3,(H,29,33)