2-[1-adamantylcarbamoyl(propyl)amino]-N-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]ethanamide

Systemtic Name: 2-[1-adamantylcarbamoyl(propyl)amino]-N-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(propyl)amino]-N-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-propylamino]-N-[2-(2,4-dimethylphenyl)-5-phenyl-3-pyrazolyl]acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(propyl)amino]-N-[2-(2,4-dimethylphenyl)-5-phenylpyrazol-3-yl]acetamide Traditional Name: 2-[1-adamantylcarbamoyl(propyl)amino]-N-[2-(2,4-dimethylphenyl)-5-phenyl-pyrazol-3-yl]acetamide Formula: C33H41N5O2 MolecularWeight: 539.71094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H41N5O2/c1-4-12-37(32(40)35-33-18-24-14-25(19-33)16-26(15-24)20-33)21-31(39)34-30-17-28(27-8-6-5-7-9-27)36-38(30)29-11-10-22(2)13-23(29)3/h5-11,13,17,24-26H,4,12,14-16,18-21H2,1-3H3,(H,34,39)(H,35,40)