N-(2-adamantyl)-4-bromanyl-2-ethyl-pyrazole-3-carboxamide

Systemtic Name: N-(2-adamantyl)-4-bromanyl-2-ethyl-pyrazole-3-carboxamide Openeye Name: N-(2-adamantyl)-4-bromo-2-ethyl-pyrazole-3-carboxamide CAS Name: N-(2-adamantyl)-4-bromo-2-ethyl-3-pyrazolecarboxamide IUPAC Name: N-(2-adamantyl)-4-bromo-2-ethylpyrazole-3-carboxamide Traditional Name: N-(2-adamantyl)-4-bromo-2-ethyl-pyrazole-3-carboxamide Formula: C16H22BrN3O MolecularWeight: 352.26938

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)C(=O)NC2C3CC4CC(C3)CC2C4

Isomeric SMILES

CCN1C(=C(C=N1)Br)C(=O)NC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C16H22BrN3O/c1-2-20-15(13(17)8-18-20)16(21)19-14-11-4-9-3-10(6-11)7-12(14)5-9/h8-12,14H,2-7H2,1H3,(H,19,21)