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

Systemtic Name: 2-[1-adamantylcarbamoyl(butyl)amino]-N-[2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl]ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(butyl)amino]-N-[2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl]acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-butylamino]-N-[2-(4-methoxyphenyl)-5-phenyl-3-pyrazolyl]acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(butyl)amino]-N-[2-(4-methoxyphenyl)-5-phenylpyrazol-3-yl]acetamide Traditional Name: 2-[1-adamantylcarbamoyl(butyl)amino]-N-[2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl]acetamide Formula: C33H41N5O3 MolecularWeight: 555.71034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H41N5O3/c1-3-4-14-37(32(40)35-33-19-23-15-24(20-33)17-25(16-23)21-33)22-31(39)34-30-18-29(26-8-6-5-7-9-26)36-38(30)27-10-12-28(41-2)13-11-27/h5-13,18,23-25H,3-4,14-17,19-22H2,1-2H3,(H,34,39)(H,35,40)