5-chloranyl-1-cyclopropyl-N-[(1S,3S)-5-oxidanyl-2-adamantyl]pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-1-cyclopropyl-N-[(1S,3S)-5-oxidanyl-2-adamantyl]pyrazole-4-carboxamide Openeye Name: 5-chloro-1-cyclopropyl-N-[(1S,3S)-5-hydroxy-2-adamantyl]pyrazole-4-carboxamide CAS Name: 5-chloro-1-cyclopropyl-N-[(1S,3S)-5-hydroxy-2-adamantyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-1-cyclopropyl-N-[(1S,3S)-5-hydroxy-2-adamantyl]pyrazole-4-carboxamide Traditional Name: 5-chloro-1-cyclopropyl-N-[(1S,3S)-5-hydroxy-2-adamantyl]pyrazole-4-carboxamide Formula: C17H22ClN3O2 MolecularWeight: 335.82848

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=C(C=N2)C(=O)NC3C4CC5CC3CC(C5)(C4)O)Cl

Isomeric SMILES

C1CC1N2C(=C(C=N2)C(=O)NC3[C@H]4CC5C[C@H]3CC(C4)(C5)O)Cl

InChI

InChI=1S/C17H22ClN3O2/c18-15-13(8-19-21(15)12-1-2-12)16(22)20-14-10-3-9-4-11(14)7-17(23,5-9)6-10/h8-12,14,23H,1-7H2,(H,20,22)/t9?,10-,11-,14?,17?/m0/s1