2-[1-adamantylcarbamoyl(2-methoxyethyl)amino]-N-[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]ethanamide

Systemtic Name: 2-[1-adamantylcarbamoyl(2-methoxyethyl)amino]-N-[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(2-methoxyethyl)amino]-N-[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-(2-methoxyethyl)amino]-N-[2-(4-fluorophenyl)-5-phenyl-3-pyrazolyl]acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(2-methoxyethyl)amino]-N-[2-(4-fluorophenyl)-5-phenylpyrazol-3-yl]acetamide Traditional Name: 2-[1-adamantylcarbamoyl(2-methoxyethyl)amino]-N-[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]acetamide Formula: C31H36FN5O3 MolecularWeight: 545.647643

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C31H36FN5O3/c1-40-12-11-36(30(39)34-31-17-21-13-22(18-31)15-23(14-21)19-31)20-29(38)33-28-16-27(24-5-3-2-4-6-24)35-37(28)26-9-7-25(32)8-10-26/h2-10,16,21-23H,11-15,17-20H2,1H3,(H,33,38)(H,34,39)