S-[2-(propanoylamino)ethyl] 2-methyl-3-oxidanyl-pent-4-enethioate

Systemtic Name: S-[2-(propanoylamino)ethyl] 2-methyl-3-oxidanyl-pent-4-enethioate Openeye Name: S-[2-(propanoylamino)ethyl] 3-hydroxy-2-methyl-pent-4-enethioate CAS Name: 3-hydroxy-2-methyl-4-pentenethioic acid S-[2-(1-oxopropylamino)ethyl] ester IUPAC Name: S-[2-(propanoylamino)ethyl] 3-hydroxy-2-methylpent-4-enethioate Traditional Name: 3-hydroxy-2-methyl-pent-4-enethioic acid S-(2-propionamidoethyl) ester Formula: C11H19NO3S MolecularWeight: 245.33846

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NCCSC(=O)C(C)C(C=C)O

Isomeric SMILES

CCC(=O)NCCSC(=O)C(C)C(C=C)O

InChI

InChI=1S/C11H19NO3S/c1-4-9(13)8(3)11(15)16-7-6-12-10(14)5-2/h4,8-9,13H,1,5-7H2,2-3H3,(H,12,14)