N-(2-adamantyl)-5-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-(2-adamantyl)-5-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(2-adamantyl)-5-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-1-phenyl-pyrazole-4-carboxamide CAS Name: N-(2-adamantyl)-5-[(2S)-2-(hydroxymethyl)-1-pyrrolidinyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(2-adamantyl)-5-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-(2-adamantyl)-5-[(2S)-2-methylolpyrrolidino]-1-phenyl-pyrazole-4-carboxamide Formula: C25H32N4O2 MolecularWeight: 420.54718

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=C(C=NN2C3=CC=CC=C3)C(=O)NC4C5CC6CC(C5)CC4C6)CO

Isomeric SMILES

C1C[C@H](N(C1)C2=C(C=NN2C3=CC=CC=C3)C(=O)NC4C5CC6CC(C5)CC4C6)CO

InChI

InChI=1S/C25H32N4O2/c30-15-21-7-4-8-28(21)25-22(14-26-29(25)20-5-2-1-3-6-20)24(31)27-23-18-10-16-9-17(12-18)13-19(23)11-16/h1-3,5-6,14,16-19,21,23,30H,4,7-13,15H2,(H,27,31)/t16?,17?,18?,19?,21-,23?/m0/s1