1-[1-adamantylsulfonyl(1-adamantylsulfonylsulfanyl)methyl]sulfonyladamantane

Systemtic Name: 1-[1-adamantylsulfonyl(1-adamantylsulfonylsulfanyl)methyl]sulfonyladamantane Openeye Name: 1-[1-adamantylsulfonyl(1-adamantylsulfonylsulfanyl)methyl]sulfonyladamantane CAS Name: 1-[1-adamantylsulfonyl-(1-adamantylsulfonylthio)methyl]sulfonyladamantane IUPAC Name: 1-[1-adamantylsulfonyl(1-adamantylsulfonylsulfanyl)methyl]sulfonyladamantane Traditional Name: 1-[1-adamantylsulfonyl-(1-adamantylsulfonylthio)methyl]sulfonyladamantane Formula: C31H46O6S4 MolecularWeight: 642.95334

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)S(=O)(=O)C(SS(=O)(=O)C45CC6CC(C4)CC(C6)C5)S(=O)(=O)C78CC9CC(C7)CC(C9)C8

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)S(=O)(=O)C(SS(=O)(=O)C45CC6CC(C4)CC(C6)C5)S(=O)(=O)C78CC9CC(C7)CC(C9)C8

InChI

InChI=1S/C31H46O6S4/c32-39(33,29-10-19-1-20(11-29)3-21(2-19)12-29)28(40(34,35)30-13-22-4-23(14-30)6-24(5-22)15-30)38-41(36,37)31-16-25-7-26(17-31)9-27(8-25)18-31/h19-28H,1-18H2