2-cyano-3-[2,2-dimethyl-4,6-bis(oxidanylidene)-1,3-dioxan-5-yl]-5-methyl-hexanethioamide

Systemtic Name: 2-cyano-3-[2,2-dimethyl-4,6-bis(oxidanylidene)-1,3-dioxan-5-yl]-5-methyl-hexanethioamide Openeye Name: 2-cyano-3-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-yl)-5-methyl-hexanethioamide CAS Name: 2-cyano-3-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-yl)-5-methylhexanethioamide IUPAC Name: 2-cyano-3-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-yl)-5-methylhexanethioamide Traditional Name: 2-cyano-3-(4,6-diketo-2,2-dimethyl-1,3-dioxan-5-yl)-5-methyl-hexanethioamide Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1C(=O)OC(OC1=O)(C)C)C(C#N)C(=S)N

Isomeric SMILES

CC(C)CC(C1C(=O)OC(OC1=O)(C)C)C(C#N)C(=S)N

InChI

InChI=1S/C14H20N2O4S/c1-7(2)5-8(9(6-15)11(16)21)10-12(17)19-14(3,4)20-13(10)18/h7-10H,5H2,1-4H3,(H2,16,21)