tert-butyl 2,6-dimethyl-3-oxidanylidene-4-sulfanylidene-2H-pyridine-1-carboxylate

Systemtic Name: tert-butyl 2,6-dimethyl-3-oxidanylidene-4-sulfanylidene-2H-pyridine-1-carboxylate Openeye Name: tert-butyl 2,6-dimethyl-3-oxo-4-thioxo-2H-pyridine-1-carboxylate CAS Name: 2,6-dimethyl-3-oxo-4-sulfanylidene-2H-pyridine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2,6-dimethyl-3-oxo-4-sulfanylidene-2H-pyridine-1-carboxylate Traditional Name: 3-keto-2,6-dimethyl-4-thioxo-2H-pyridine-1-carboxylic acid tert-butyl ester Formula: C12H17NO3S MolecularWeight: 255.33328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)C(=S)C=C(N1C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1C(=O)C(=S)C=C(N1C(=O)OC(C)(C)C)C

InChI

InChI=1S/C12H17NO3S/c1-7-6-9(17)10(14)8(2)13(7)11(15)16-12(3,4)5/h6,8H,1-5H3