2-[1-adamantylcarbamoyl(butyl)amino]-N-[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]ethanamide

Systemtic Name: 2-[1-adamantylcarbamoyl(butyl)amino]-N-[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(butyl)amino]-N-[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-butylamino]-N-[2-(2-chlorophenyl)-5-phenyl-3-pyrazolyl]acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(butyl)amino]-N-[2-(2-chlorophenyl)-5-phenylpyrazol-3-yl]acetamide Traditional Name: 2-[1-adamantylcarbamoyl(butyl)amino]-N-[2-(2-chlorophenyl)-5-phenyl-pyrazol-3-yl]acetamide Formula: C32H38ClN5O2 MolecularWeight: 560.12942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=CC(=NN1C2=CC=CC=C2Cl)C3=CC=CC=C3)C(=O)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCCCN(CC(=O)NC1=CC(=NN1C2=CC=CC=C2Cl)C3=CC=CC=C3)C(=O)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C32H38ClN5O2/c1-2-3-13-37(31(40)35-32-18-22-14-23(19-32)16-24(15-22)20-32)21-30(39)34-29-17-27(25-9-5-4-6-10-25)36-38(29)28-12-8-7-11-26(28)33/h4-12,17,22-24H,2-3,13-16,18-21H2,1H3,(H,34,39)(H,35,40)