1-[6-(1-adamantylsulfanyl)-3,5-dimethyl-2,3-bis(oxidanyl)-2,6-dihydropyridin-1-yl]ethanone

Systemtic Name: 1-[6-(1-adamantylsulfanyl)-3,5-dimethyl-2,3-bis(oxidanyl)-2,6-dihydropyridin-1-yl]ethanone Openeye Name: 1-[6-(1-adamantylsulfanyl)-2,3-dihydroxy-3,5-dimethyl-2,6-dihydropyridin-1-yl]ethanone CAS Name: 1-[6-(1-adamantylthio)-2,3-dihydroxy-3,5-dimethyl-2,6-dihydropyridin-1-yl]ethanone IUPAC Name: 1-[6-(1-adamantylsulfanyl)-2,3-dihydroxy-3,5-dimethyl-2,6-dihydropyridin-1-yl]ethanone Traditional Name: 1-[6-(1-adamantylthio)-2,3-dihydroxy-3,5-dimethyl-2,6-dihydropyridin-1-yl]ethanone Formula: C19H29NO3S MolecularWeight: 351.50346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(C(N(C1SC23CC4CC(C2)CC(C4)C3)C(=O)C)O)(C)O

Isomeric SMILES

CC1=CC(C(N(C1SC23CC4CC(C2)CC(C4)C3)C(=O)C)O)(C)O

InChI

InChI=1S/C19H29NO3S/c1-11-7-18(3,23)17(22)20(12(2)21)16(11)24-19-8-13-4-14(9-19)6-15(5-13)10-19/h7,13-17,22-23H,4-6,8-10H2,1-3H3