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

Systemtic Name: 2-[1-adamantylcarbamoyl(butyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(butyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-butylamino]-N-[5-tert-butyl-2-(4-methoxyphenyl)-3-pyrazolyl]acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(butyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]acetamide Traditional Name: 2-[1-adamantylcarbamoyl(butyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]acetamide Formula: C31H45N5O3 MolecularWeight: 535.7207

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H45N5O3/c1-6-7-12-35(29(38)33-31-17-21-13-22(18-31)15-23(14-21)19-31)20-28(37)32-27-16-26(30(2,3)4)34-36(27)24-8-10-25(39-5)11-9-24/h8-11,16,21-23H,6-7,12-15,17-20H2,1-5H3,(H,32,37)(H,33,38)