S-[3-oxidanylidene-3-(propylamino)propyl] 3,3-dimethyl-2,4-bis(oxidanyl)butanethioate

Systemtic Name: S-[3-oxidanylidene-3-(propylamino)propyl] 3,3-dimethyl-2,4-bis(oxidanyl)butanethioate Openeye Name: S-[3-oxo-3-(propylamino)propyl] 2,4-dihydroxy-3,3-dimethyl-butanethioate CAS Name: 2,4-dihydroxy-3,3-dimethylbutanethioic acid S-[3-oxo-3-(propylamino)propyl] ester IUPAC Name: S-[3-oxo-3-(propylamino)propyl] 2,4-dihydroxy-3,3-dimethylbutanethioate Traditional Name: 2,4-dihydroxy-3,3-dimethyl-butanethioic acid S-[3-keto-3-(propylamino)propyl] ester Formula: C12H23NO4S MolecularWeight: 277.38032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CCSC(=O)C(C(C)(C)CO)O

Isomeric SMILES

CCCNC(=O)CCSC(=O)C(C(C)(C)CO)O

InChI

InChI=1S/C12H23NO4S/c1-4-6-13-9(15)5-7-18-11(17)10(16)12(2,3)8-14/h10,14,16H,4-8H2,1-3H3,(H,13,15)