N-(2-adamantyl)-5-(2-oxidanylpropylamino)-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-(2-adamantyl)-5-(2-oxidanylpropylamino)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(2-adamantyl)-5-(2-hydroxypropylamino)-1-phenyl-pyrazole-4-carboxamide CAS Name: N-(2-adamantyl)-5-(2-hydroxypropylamino)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(2-adamantyl)-5-(2-hydroxypropylamino)-1-phenylpyrazole-4-carboxamide Traditional Name: N-(2-adamantyl)-5-(2-hydroxypropylamino)-1-phenyl-pyrazole-4-carboxamide Formula: C23H30N4O2 MolecularWeight: 394.5099

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=C(C=NN1C2=CC=CC=C2)C(=O)NC3C4CC5CC(C4)CC3C5)O

Isomeric SMILES

CC(CNC1=C(C=NN1C2=CC=CC=C2)C(=O)NC3C4CC5CC(C4)CC3C5)O

InChI

InChI=1S/C23H30N4O2/c1-14(28)12-24-22-20(13-25-27(22)19-5-3-2-4-6-19)23(29)26-21-17-8-15-7-16(10-17)11-18(21)9-15/h2-6,13-18,21,24,28H,7-12H2,1H3,(H,26,29)