N-(2-adamantyl)-4-bromanyl-1-methyl-pyrazole-3-carboxamide

Systemtic Name: N-(2-adamantyl)-4-bromanyl-1-methyl-pyrazole-3-carboxamide Openeye Name: N-(2-adamantyl)-4-bromo-1-methyl-pyrazole-3-carboxamide CAS Name: N-(2-adamantyl)-4-bromo-1-methyl-3-pyrazolecarboxamide IUPAC Name: N-(2-adamantyl)-4-bromo-1-methylpyrazole-3-carboxamide Traditional Name: N-(2-adamantyl)-4-bromo-1-methyl-pyrazole-3-carboxamide Formula: C15H20BrN3O MolecularWeight: 338.2428

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NC2C3CC4CC(C3)CC2C4)Br

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NC2C3CC4CC(C3)CC2C4)Br

InChI

InChI=1S/C15H20BrN3O/c1-19-7-12(16)14(18-19)15(20)17-13-10-3-8-2-9(5-10)6-11(13)4-8/h7-11,13H,2-6H2,1H3,(H,17,20)