S-ethyl 3,5-bis(oxidanylidene)-4-propanoyl-cyclohexane-1-carbothioate

Systemtic Name: S-ethyl 3,5-bis(oxidanylidene)-4-propanoyl-cyclohexane-1-carbothioate Openeye Name: S-ethyl 3,5-dioxo-4-propanoyl-cyclohexanecarbothioate CAS Name: 3,5-dioxo-4-(1-oxopropyl)-1-cyclohexanecarbothioic acid S-ethyl ester IUPAC Name: S-ethyl 3,5-dioxo-4-propanoylcyclohexane-1-carbothioate Traditional Name: 3,5-diketo-4-propionyl-cyclohexanecarbothioic acid S-ethyl ester Formula: C12H16O4S MolecularWeight: 256.31804

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1C(=O)CC(CC1=O)C(=O)SCC

Isomeric SMILES

CCC(=O)C1C(=O)CC(CC1=O)C(=O)SCC

InChI

InChI=1S/C12H16O4S/c1-3-8(13)11-9(14)5-7(6-10(11)15)12(16)17-4-2/h7,11H,3-6H2,1-2H3