1-[2-(3-methoxypropyl)pyrazol-3-yl]-N-[(1S,3S)-5-oxidanyl-2-adamantyl]pyrazole-4-carboxamide

Systemtic Name: 1-[2-(3-methoxypropyl)pyrazol-3-yl]-N-[(1S,3S)-5-oxidanyl-2-adamantyl]pyrazole-4-carboxamide Openeye Name: N-[(1S,3S)-5-hydroxy-2-adamantyl]-1-[2-(3-methoxypropyl)pyrazol-3-yl]pyrazole-4-carboxamide CAS Name: N-[(1S,3S)-5-hydroxy-2-adamantyl]-1-[2-(3-methoxypropyl)-3-pyrazolyl]-4-pyrazolecarboxamide IUPAC Name: N-[(1S,3S)-5-hydroxy-2-adamantyl]-1-[2-(3-methoxypropyl)pyrazol-3-yl]pyrazole-4-carboxamide Traditional Name: N-[(1S,3S)-5-hydroxy-2-adamantyl]-1-[2-(3-methoxypropyl)pyrazol-3-yl]pyrazole-4-carboxamide Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=CC=N1)N2C=C(C=N2)C(=O)NC3C4CC5CC3CC(C5)(C4)O

Isomeric SMILES

COCCCN1C(=CC=N1)N2C=C(C=N2)C(=O)NC3[C@H]4CC5C[C@H]3CC(C4)(C5)O

InChI

InChI=1S/C21H29N5O3/c1-29-6-2-5-25-18(3-4-22-25)26-13-17(12-23-26)20(27)24-19-15-7-14-8-16(19)11-21(28,9-14)10-15/h3-4,12-16,19,28H,2,5-11H2,1H3,(H,24,27)/t14?,15-,16-,19?,21?/m0/s1