[4-(1-adamantyl)-3,5-dimethyl-pyrazol-1-yl]-(2-ethylpyrazol-3-yl)methanone

Systemtic Name: [4-(1-adamantyl)-3,5-dimethyl-pyrazol-1-yl]-(2-ethylpyrazol-3-yl)methanone Openeye Name: [4-(1-adamantyl)-3,5-dimethyl-pyrazol-1-yl]-(2-ethylpyrazol-3-yl)methanone CAS Name: [4-(1-adamantyl)-3,5-dimethyl-1-pyrazolyl]-(2-ethyl-3-pyrazolyl)methanone IUPAC Name: [4-(1-adamantyl)-3,5-dimethylpyrazol-1-yl]-(2-ethylpyrazol-3-yl)methanone Traditional Name: [4-(1-adamantyl)-3,5-dimethyl-pyrazol-1-yl]-(2-ethylpyrazol-3-yl)methanone Formula: C21H28N4O MolecularWeight: 352.47322

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)C(=O)N2C(=C(C(=N2)C)C34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CCN1C(=CC=N1)C(=O)N2C(=C(C(=N2)C)C34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C21H28N4O/c1-4-24-18(5-6-22-24)20(26)25-14(3)19(13(2)23-25)21-10-15-7-16(11-21)9-17(8-15)12-21/h5-6,15-17H,4,7-12H2,1-3H3