ethyl 2-azanyl-4-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-azanyl-4-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-amino-4-(2-ethoxy-2-oxo-ethyl)sulfanyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-amino-4-[(2-ethoxy-2-oxoethyl)thio]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-4-(2-ethoxy-2-oxoethyl)sulfanylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-amino-4-[(2-ethoxy-2-keto-ethyl)thio]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C13H15N3O4S2 MolecularWeight: 341.4059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC(=NC2=C1C=C(S2)C(=O)OCC)N

Isomeric SMILES

CCOC(=O)CSC1=NC(=NC2=C1C=C(S2)C(=O)OCC)N

InChI

InChI=1S/C13H15N3O4S2/c1-3-19-9(17)6-21-10-7-5-8(12(18)20-4-2)22-11(7)16-13(14)15-10/h5H,3-4,6H2,1-2H3,(H2,14,15,16)