2-[butylcarbamoyl(3-methylbutyl)amino]-N-[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]ethanamide

Systemtic Name: 2-[butylcarbamoyl(3-methylbutyl)amino]-N-[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]ethanamide Openeye Name: 2-[butylcarbamoyl(isopentyl)amino]-N-[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]acetamide CAS Name: 2-[[butylamino(oxo)methyl]-(3-methylbutyl)amino]-N-[2-(4-fluorophenyl)-5-phenyl-3-pyrazolyl]acetamide IUPAC Name: 2-[butylcarbamoyl(3-methylbutyl)amino]-N-[2-(4-fluorophenyl)-5-phenylpyrazol-3-yl]acetamide Traditional Name: 2-[butylcarbamoyl(isoamyl)amino]-N-[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]acetamide Formula: C27H34FN5O2 MolecularWeight: 479.589563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(CCC(C)C)CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)N(CCC(C)C)CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C27H34FN5O2/c1-4-5-16-29-27(35)32(17-15-20(2)3)19-26(34)30-25-18-24(21-9-7-6-8-10-21)31-33(25)23-13-11-22(28)12-14-23/h6-14,18,20H,4-5,15-17,19H2,1-3H3,(H,29,35)(H,30,34)