ethyl 4-oxidanylidene-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidine-2-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidine-2-carboxylate Openeye Name: ethyl 4-oxo-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidine-2-carboxylate CAS Name: 4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidine-2-carboxylate Traditional Name: 4-keto-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=C(C3=C(S2)CCCC3)C(=O)N1

Isomeric SMILES

CCOC(=O)C1=NC2=C(C3=C(S2)CCCC3)C(=O)N1

InChI

InChI=1S/C13H14N2O3S/c1-2-18-13(17)10-14-11(16)9-7-5-3-4-6-8(7)19-12(9)15-10/h2-6H2,1H3,(H,14,15,16)