1,2-bis(1-adamantyl)-2-sulfanylidene-ethanone

Systemtic Name: 1,2-bis(1-adamantyl)-2-sulfanylidene-ethanone Openeye Name: 1,2-bis(1-adamantyl)-2-thioxo-ethanone CAS Name: 1,2-bis(1-adamantyl)-2-sulfanylideneethanone IUPAC Name: 1,2-bis(1-adamantyl)-2-sulfanylideneethanone Traditional Name: 1,2-bis(1-adamantyl)-2-thioxo-ethanone Formula: C22H30OS MolecularWeight: 342.538

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)C(=S)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)C(=S)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C22H30OS/c23-19(21-7-13-1-14(8-21)3-15(2-13)9-21)20(24)22-10-16-4-17(11-22)6-18(5-16)12-22/h13-18H,1-12H2