[5-tert-butyl-3-(3-sulfanylpropanoyl)-2H-1,3,4-thiadiazol-2-yl] hydrogen carbonate

Systemtic Name: [5-tert-butyl-3-(3-sulfanylpropanoyl)-2H-1,3,4-thiadiazol-2-yl] hydrogen carbonate Openeye Name: [5-tert-butyl-3-(3-sulfanylpropanoyl)-2H-1,3,4-thiadiazol-2-yl] hydrogen carbonate CAS Name: carbonic acid [5-tert-butyl-3-(3-mercapto-1-oxopropyl)-2H-1,3,4-thiadiazol-2-yl] ester IUPAC Name: [5-tert-butyl-3-(3-sulfanylpropanoyl)-2H-1,3,4-thiadiazol-2-yl] hydrogen carbonate Traditional Name: carbonic acid [5-tert-butyl-3-(3-mercaptopropanoyl)-2H-1,3,4-thiadiazol-2-yl] ester Formula: C10H16N2O4S2 MolecularWeight: 292.37504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(S1)OC(=O)O)C(=O)CCS

Isomeric SMILES

CC(C)(C)C1=NN(C(S1)OC(=O)O)C(=O)CCS

InChI

InChI=1S/C10H16N2O4S2/c1-10(2,3)7-11-12(6(13)4-5-17)8(18-7)16-9(14)15/h8,17H,4-5H2,1-3H3,(H,14,15)