N-(1-adamantyl)-4-bromanyl-1-ethyl-pyrazole-3-carboxamide

Systemtic Name: N-(1-adamantyl)-4-bromanyl-1-ethyl-pyrazole-3-carboxamide Openeye Name: N-(1-adamantyl)-4-bromo-1-ethyl-pyrazole-3-carboxamide CAS Name: N-(1-adamantyl)-4-bromo-1-ethyl-3-pyrazolecarboxamide IUPAC Name: N-(1-adamantyl)-4-bromo-1-ethylpyrazole-3-carboxamide Traditional Name: N-(1-adamantyl)-4-bromo-1-ethyl-pyrazole-3-carboxamide Formula: C16H22BrN3O MolecularWeight: 352.26938

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC23CC4CC(C2)CC(C4)C3)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC23CC4CC(C2)CC(C4)C3)Br

InChI

InChI=1S/C16H22BrN3O/c1-2-20-9-13(17)14(19-20)15(21)18-16-6-10-3-11(7-16)5-12(4-10)8-16/h9-12H,2-8H2,1H3,(H,18,21)