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

Systemtic Name: 2-cyano-3-[2,2-dimethyl-4,6-bis(oxidanylidene)-1,3-dioxan-5-yl]pentanethioamide Openeye Name: 2-cyano-3-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-yl)pentanethioamide CAS Name: 2-cyano-3-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-yl)pentanethioamide IUPAC Name: 2-cyano-3-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-yl)pentanethioamide Traditional Name: 2-cyano-3-(4,6-diketo-2,2-dimethyl-1,3-dioxan-5-yl)thiovaleramide Formula: C12H16N2O4S MolecularWeight: 284.33144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O4S/c1-4-6(7(5-13)9(14)19)8-10(15)17-12(2,3)18-11(8)16/h6-8H,4H2,1-3H3,(H2,14,19)