2-(1-adamantyl)-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[3,5-dimethyl-1-(o-tolylmethyl)pyrazol-4-yl]acetamide CAS Name: 2-(1-adamantyl)-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]-4-pyrazolyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[3,5-dimethyl-1-[(2-methylphenyl)methyl]pyrazol-4-yl]acetamide Traditional Name: 2-(1-adamantyl)-N-[3,5-dimethyl-1-(2-methylbenzyl)pyrazol-4-yl]acetamide Formula: C25H33N3O MolecularWeight: 391.54902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)CC34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=O)CC34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C25H33N3O/c1-16-6-4-5-7-22(16)15-28-18(3)24(17(2)27-28)26-23(29)14-25-11-19-8-20(12-25)10-21(9-19)13-25/h4-7,19-21H,8-15H2,1-3H3,(H,26,29)