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

Systemtic Name: 2-[1-adamantylcarbamoyl(pentyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(pentyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-pentylamino]-N-[5-tert-butyl-2-(4-methoxyphenyl)-3-pyrazolyl]acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(pentyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]acetamide Traditional Name: 2-[1-adamantylcarbamoyl(amyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]acetamide Formula: C32H47N5O3 MolecularWeight: 549.74728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)OC)C(C)(C)C)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCCCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)OC)C(C)(C)C)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C32H47N5O3/c1-6-7-8-13-36(30(39)34-32-18-22-14-23(19-32)16-24(15-22)20-32)21-29(38)33-28-17-27(31(2,3)4)35-37(28)25-9-11-26(40-5)12-10-25/h9-12,17,22-24H,6-8,13-16,18-21H2,1-5H3,(H,33,38)(H,34,39)