1,4-bis(1-adamantyl)-3,5-dimethyl-pyrazole

Systemtic Name: 1,4-bis(1-adamantyl)-3,5-dimethyl-pyrazole Openeye Name: 1,4-bis(1-adamantyl)-3,5-dimethyl-pyrazole CAS Name: 1,4-bis(1-adamantyl)-3,5-dimethylpyrazole IUPAC Name: 1,4-bis(1-adamantyl)-3,5-dimethylpyrazole Traditional Name: 1,4-bis(1-adamantyl)-3,5-dimethyl-pyrazole Formula: C25H36N2 MolecularWeight: 364.56674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C23CC4CC(C2)CC(C4)C3)C)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CC1=C(C(=NN1C23CC4CC(C2)CC(C4)C3)C)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C25H36N2/c1-15-23(24-9-17-3-18(10-24)5-19(4-17)11-24)16(2)27(26-15)25-12-20-6-21(13-25)8-22(7-20)14-25/h17-22H,3-14H2,1-2H3