1-(2-methylsulfanyl-2-adamantyl)-3-phenyl-pyrazole

Systemtic Name: 1-(2-methylsulfanyl-2-adamantyl)-3-phenyl-pyrazole Openeye Name: 1-(2-methylsulfanyl-2-adamantyl)-3-phenyl-pyrazole CAS Name: 1-[2-(methylthio)-2-adamantyl]-3-phenylpyrazole IUPAC Name: 1-(2-methylsulfanyl-2-adamantyl)-3-phenylpyrazole Traditional Name: 1-[2-(methylthio)-2-adamantyl]-3-phenyl-pyrazole Formula: C20H24N2S MolecularWeight: 324.48296

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Descriptors Computed from Structure

Canonical SMILES:

CSC1(C2CC3CC(C2)CC1C3)N4C=CC(=N4)C5=CC=CC=C5

Isomeric SMILES

CSC1(C2CC3CC(C2)CC1C3)N4C=CC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C20H24N2S/c1-23-20(17-10-14-9-15(12-17)13-18(20)11-14)22-8-7-19(21-22)16-5-3-2-4-6-16/h2-8,14-15,17-18H,9-13H2,1H3