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

Systemtic Name: 2-[1-adamantylcarbamoyl(methyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]ethanamide Openeye Name: 2-[1-adamantylcarbamoyl(methyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]acetamide CAS Name: 2-[[(1-adamantylamino)-oxomethyl]-methylamino]-N-[5-tert-butyl-2-(4-methoxyphenyl)-3-pyrazolyl]acetamide IUPAC Name: 2-[1-adamantylcarbamoyl(methyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]acetamide Traditional Name: 2-[1-adamantylcarbamoyl(methyl)amino]-N-[5-tert-butyl-2-(4-methoxyphenyl)pyrazol-3-yl]acetamide Formula: C28H39N5O3 MolecularWeight: 493.64096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CN(C)C(=O)NC23CC4CC(C2)CC(C4)C3)C5=CC=C(C=C5)OC

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CN(C)C(=O)NC23CC4CC(C2)CC(C4)C3)C5=CC=C(C=C5)OC

InChI

InChI=1S/C28H39N5O3/c1-27(2,3)23-13-24(33(31-23)21-6-8-22(36-5)9-7-21)29-25(34)17-32(4)26(35)30-28-14-18-10-19(15-28)12-20(11-18)16-28/h6-9,13,18-20H,10-12,14-17H2,1-5H3,(H,29,34)(H,30,35)