4-methyl-6-propylsulfanyl-2-thiophen-2-yl-pyrimidine-5-carboxylate

Systemtic Name: 4-methyl-6-propylsulfanyl-2-thiophen-2-yl-pyrimidine-5-carboxylate Openeye Name: 4-methyl-6-propylsulfanyl-2-(2-thienyl)pyrimidine-5-carboxylate CAS Name: 4-methyl-6-(propylthio)-2-thiophen-2-yl-5-pyrimidinecarboxylate IUPAC Name: 4-methyl-6-propylsulfanyl-2-thiophen-2-ylpyrimidine-5-carboxylate Traditional Name: 4-methyl-6-(propylthio)-2-(2-thienyl)pyrimidine-5-carboxylate Formula: C13H13N2O2S2- MolecularWeight: 293.38452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC(=NC(=C1C(=O)[O-])C)C2=CC=CS2

Isomeric SMILES

CCCSC1=NC(=NC(=C1C(=O)[O-])C)C2=CC=CS2

InChI

InChI=1S/C13H14N2O2S2/c1-3-6-19-12-10(13(16)17)8(2)14-11(15-12)9-5-4-7-18-9/h4-5,7H,3,6H2,1-2H3,(H,16,17)/p-1