[2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl] pyrazine-2-carboxylate

Systemtic Name: [2-(2,5-dimethylthiophen-3-yl)-2-oxidanylidene-ethyl] pyrazine-2-carboxylate Openeye Name: [2-(2,5-dimethyl-3-thienyl)-2-oxo-ethyl] pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [2-(2,5-dimethyl-3-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,5-dimethylthiophen-3-yl)-2-oxoethyl] pyrazine-2-carboxylate Traditional Name: pyrazinic acid [2-(2,5-dimethyl-3-thienyl)-2-keto-ethyl] ester Formula: C13H12N2O3S MolecularWeight: 276.31098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)COC(=O)C2=NC=CN=C2

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)COC(=O)C2=NC=CN=C2

InChI

InChI=1S/C13H12N2O3S/c1-8-5-10(9(2)19-8)12(16)7-18-13(17)11-6-14-3-4-15-11/h3-6H,7H2,1-2H3