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

Systemtic Name: 2-[cyclohexylcarbamoyl(3-methylbutyl)amino]-N-[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]ethanamide Openeye Name: 2-[cyclohexylcarbamoyl(isopentyl)amino]-N-[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]acetamide CAS Name: 2-[[(cyclohexylamino)-oxomethyl]-(3-methylbutyl)amino]-N-[2-(4-fluorophenyl)-5-phenyl-3-pyrazolyl]acetamide IUPAC Name: 2-[cyclohexylcarbamoyl(3-methylbutyl)amino]-N-[2-(4-fluorophenyl)-5-phenylpyrazol-3-yl]acetamide Traditional Name: 2-[cyclohexylcarbamoyl(isoamyl)amino]-N-[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]acetamide Formula: C29H36FN5O2 MolecularWeight: 505.626843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC4CCCCC4

Isomeric SMILES

CC(C)CCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC4CCCCC4

InChI

InChI=1S/C29H36FN5O2/c1-21(2)17-18-34(29(37)31-24-11-7-4-8-12-24)20-28(36)32-27-19-26(22-9-5-3-6-10-22)33-35(27)25-15-13-23(30)14-16-25/h3,5-6,9-10,13-16,19,21,24H,4,7-8,11-12,17-18,20H2,1-2H3,(H,31,37)(H,32,36)