2-[1-adamantylcarbamoyl(propan-2-yl)amino]-N-(2,5-ditert-butylpyrazol-3-yl)ethanamide

Systemtic Name: 2-[1-adamantylcarbamoyl(propan-2-yl)amino]-N-(2,5-ditert-butylpyrazol-3-yl)ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(isopropyl)amino]-N-(2,5-ditert-butylpyrazol-3-yl)acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-propan-2-ylamino]-N-(2,5-ditert-butyl-3-pyrazolyl)acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(propan-2-yl)amino]-N-(2,5-ditert-butylpyrazol-3-yl)acetamide Traditional Name: 2-[1-adamantylcarbamoyl(isopropyl)amino]-N-(2,5-ditert-butylpyrazol-3-yl)acetamide Formula: C27H45N5O2 MolecularWeight: 471.6785

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)NC1=CC(=NN1C(C)(C)C)C(C)(C)C)C(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)N(CC(=O)NC1=CC(=NN1C(C)(C)C)C(C)(C)C)C(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C27H45N5O2/c1-17(2)31(24(34)29-27-13-18-9-19(14-27)11-20(10-18)15-27)16-23(33)28-22-12-21(25(3,4)5)30-32(22)26(6,7)8/h12,17-20H,9-11,13-16H2,1-8H3,(H,28,33)(H,29,34)