2-cyano-3-(2,2-dimethyl-4-oxidanyl-6-oxidanylidene-1,3-dioxin-5-yl)-3-thiophen-2-yl-propanethioamide; 4-methylmorpholine

Systemtic Name: 2-cyano-3-(2,2-dimethyl-4-oxidanyl-6-oxidanylidene-1,3-dioxin-5-yl)-3-thiophen-2-yl-propanethioamide; 4-methylmorpholine Openeye Name: 2-cyano-3-(4-hydroxy-2,2-dimethyl-6-oxo-1,3-dioxin-5-yl)-3-(2-thienyl)propanethioamide; 4-methylmorpholine CAS Name: 2-cyano-3-(4-hydroxy-2,2-dimethyl-6-oxo-1,3-dioxin-5-yl)-3-thiophen-2-ylpropanethioamide; 4-methylmorpholine IUPAC Name: 2-cyano-3-(4-hydroxy-2,2-dimethyl-6-oxo-1,3-dioxin-5-yl)-3-thiophen-2-ylpropanethioamide; 4-methylmorpholine Traditional Name: 2-cyano-3-(4-hydroxy-6-keto-2,2-dimethyl-1,3-dioxin-5-yl)-3-(2-thienyl)thiopropionamide; 4-methylmorpholine Formula: C19H25N3O5S2 MolecularWeight: 439.5489

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=C(C(=O)O1)C(C2=CC=CS2)C(C#N)C(=S)N)O)C.CN1CCOCC1

Isomeric SMILES

CC1(OC(=C(C(=O)O1)C(C2=CC=CS2)C(C#N)C(=S)N)O)C.CN1CCOCC1

InChI

InChI=1S/C14H14N2O4S2.C5H11NO/c1-14(2)19-12(17)10(13(18)20-14)9(7(6-15)11(16)21)8-4-3-5-22-8;1-6-2-4-7-5-3-6/h3-5,7,9,17H,1-2H3,(H2,16,21);2-5H2,1H3