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

Systemtic Name: 3-bromanyl-N-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 3-bromo-N-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]benzamide CAS Name: 3-bromo-N-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]benzamide IUPAC Name: 3-bromo-N-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]benzamide Traditional Name: 3-bromo-N-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-keto-ethyl]benzamide Formula: C28H26BrFN4O2 MolecularWeight: 549.434043

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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=C4)Br

Isomeric SMILES

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

InChI

InChI=1S/C28H26BrFN4O2/c1-2-3-16-33(28(36)21-10-7-11-22(29)17-21)19-27(35)31-26-18-25(20-8-5-4-6-9-20)32-34(26)24-14-12-23(30)13-15-24/h4-15,17-18H,2-3,16,19H2,1H3,(H,31,35)