methyl 2-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfanylethanoylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[2-[1,1-bis(oxidanylidene)thiolan-3-yl]sulfanylethanoylamino]-3-methyl-butanoate Openeye Name: methyl 2-[[2-(1,1-dioxothiolan-3-yl)sulfanylacetyl]amino]-3-methyl-butanoate CAS Name: 2-[[2-[(1,1-dioxo-3-thiolanyl)thio]-1-oxoethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[[2-(1,1-dioxothiolan-3-yl)sulfanylacetyl]amino]-3-methylbutanoate Traditional Name: 2-[[2-[(1,1-diketothiolan-3-yl)thio]acetyl]amino]-3-methyl-butyric acid methyl ester Formula: C12H21NO5S2 MolecularWeight: 323.42884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)CSC1CCS(=O)(=O)C1

Isomeric SMILES

CC(C)C(C(=O)OC)NC(=O)CSC1CCS(=O)(=O)C1

InChI

InChI=1S/C12H21NO5S2/c1-8(2)11(12(15)18-3)13-10(14)6-19-9-4-5-20(16,17)7-9/h8-9,11H,4-7H2,1-3H3,(H,13,14)