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

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

Click to see the large picture

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