N-(1-adamantyl)-4-iodanyl-N,2-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-(1-adamantyl)-4-iodanyl-N,2-dimethyl-pyrazole-3-carboxamide Openeye Name: N-(1-adamantyl)-4-iodo-N,2-dimethyl-pyrazole-3-carboxamide CAS Name: N-(1-adamantyl)-4-iodo-N,2-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-(1-adamantyl)-4-iodo-N,2-dimethylpyrazole-3-carboxamide Traditional Name: N-(1-adamantyl)-4-iodo-N,2-dimethyl-pyrazole-3-carboxamide Formula: C16H22IN3O MolecularWeight: 399.26985

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)I)C(=O)N(C)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN1C(=C(C=N1)I)C(=O)N(C)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C16H22IN3O/c1-19(15(21)14-13(17)9-18-20(14)2)16-6-10-3-11(7-16)5-12(4-10)8-16/h9-12H,3-8H2,1-2H3