N-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-2-methyl-benzamide

Systemtic Name: N-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-2-methyl-benzamide Openeye Name: N-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]-2-methyl-benzamide CAS Name: N-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-2-methylbenzamide IUPAC Name: N-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]-2-methylbenzamide Traditional Name: N-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-keto-ethyl]-2-methyl-benzamide Formula: C29H29FN4O2 MolecularWeight: 484.564563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)C4=CC=CC=C4C

Isomeric SMILES

CCCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)C4=CC=CC=C4C

InChI

InChI=1S/C29H29FN4O2/c1-3-4-18-33(29(36)25-13-9-8-10-21(25)2)20-28(35)31-27-19-26(22-11-6-5-7-12-22)32-34(27)24-16-14-23(30)15-17-24/h5-17,19H,3-4,18,20H2,1-2H3,(H,31,35)