S-[2-(propanoylamino)ethyl] 2-methyl-3-oxidanyl-4-propoxy-butanethioate

Systemtic Name: S-[2-(propanoylamino)ethyl] 2-methyl-3-oxidanyl-4-propoxy-butanethioate Openeye Name: S-[2-(propanoylamino)ethyl] 3-hydroxy-2-methyl-4-propoxy-butanethioate CAS Name: 3-hydroxy-2-methyl-4-propoxybutanethioic acid S-[2-(1-oxopropylamino)ethyl] ester IUPAC Name: S-[2-(propanoylamino)ethyl] 3-hydroxy-2-methyl-4-propoxybutanethioate Traditional Name: 3-hydroxy-2-methyl-4-propoxy-butanethioic acid S-(2-propionamidoethyl) ester Formula: C13H25NO4S MolecularWeight: 291.4069

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCC(C(C)C(=O)SCCNC(=O)CC)O

Isomeric SMILES

CCCOCC(C(C)C(=O)SCCNC(=O)CC)O

InChI

InChI=1S/C13H25NO4S/c1-4-7-18-9-11(15)10(3)13(17)19-8-6-14-12(16)5-2/h10-11,15H,4-9H2,1-3H3,(H,14,16)