1-adamantyl-[2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-cyclohexyl-amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: 1-adamantyl-[2-[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-cyclohexyl-amino]-2-oxidanylidene-ethyl]azanium Openeye Name: 1-adamantyl-[2-[cyclohexyl-[(3S)-1,1-dioxothiolan-3-yl]amino]-2-oxo-ethyl]ammonium CAS Name: 1-adamantyl-[2-[cyclohexyl-[(3S)-1,1-dioxo-3-thiolanyl]amino]-2-oxoethyl]ammonium IUPAC Name: 1-adamantyl-[2-[cyclohexyl-[(3S)-1,1-dioxothiolan-3-yl]amino]-2-oxoethyl]azanium Traditional Name: 1-adamantyl-[2-[cyclohexyl-[(3S)-1,1-diketothiolan-3-yl]amino]-2-keto-ethyl]ammonium Formula: C22H37N2O3S+ MolecularWeight: 409.60578

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2CCS(=O)(=O)C2)C(=O)C[NH2+]C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CCC(CC1)N([C@H]2CCS(=O)(=O)C2)C(=O)C[NH2+]C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H36N2O3S/c25-21(14-23-22-11-16-8-17(12-22)10-18(9-16)13-22)24(19-4-2-1-3-5-19)20-6-7-28(26,27)15-20/h16-20,23H,1-15H2/p+1/t16?,17?,18?,20-,22?/m0/s1