N-(1-adamantylmethyl)-3-[(4-iodanylpyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-3-[(4-iodanylpyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide Openeye Name: N-(1-adamantylmethyl)-3-[(4-iodopyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide CAS Name: N-(1-adamantylmethyl)-3-[(4-iodo-1-pyrazolyl)methyl]-1,2,4-oxadiazole-5-carboxamide IUPAC Name: N-(1-adamantylmethyl)-3-[(4-iodopyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide Traditional Name: N-(1-adamantylmethyl)-3-[(4-iodopyrazol-1-yl)methyl]-1,2,4-oxadiazole-5-carboxamide Formula: C18H22IN5O2 MolecularWeight: 467.30405

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=NC(=NO4)CN5C=C(C=N5)I

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=NC(=NO4)CN5C=C(C=N5)I

InChI

InChI=1S/C18H22IN5O2/c19-14-7-21-24(8-14)9-15-22-17(26-23-15)16(25)20-10-18-4-11-1-12(5-18)3-13(2-11)6-18/h7-8,11-13H,1-6,9-10H2,(H,20,25)