N-(2-adamantyl)-1-methyl-5-phenethyloxy-pyrazole-4-carboxamide

Systemtic Name: N-(2-adamantyl)-1-methyl-5-phenethyloxy-pyrazole-4-carboxamide Openeye Name: N-(2-adamantyl)-1-methyl-5-phenethyloxy-pyrazole-4-carboxamide CAS Name: N-(2-adamantyl)-1-methyl-5-phenethyloxy-4-pyrazolecarboxamide IUPAC Name: N-(2-adamantyl)-1-methyl-5-phenethyloxypyrazole-4-carboxamide Traditional Name: N-(2-adamantyl)-1-methyl-5-phenethyloxy-pyrazole-4-carboxamide Formula: C23H29N3O2 MolecularWeight: 379.49526

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)NC2C3CC4CC(C3)CC2C4)OCCC5=CC=CC=C5

Isomeric SMILES

CN1C(=C(C=N1)C(=O)NC2C3CC4CC(C3)CC2C4)OCCC5=CC=CC=C5

InChI

InChI=1S/C23H29N3O2/c1-26-23(28-8-7-15-5-3-2-4-6-15)20(14-24-26)22(27)25-21-18-10-16-9-17(12-18)13-19(21)11-16/h2-6,14,16-19,21H,7-13H2,1H3,(H,25,27)