4-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)butanoate

Systemtic Name: 4-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)butanoate Openeye Name: 4-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)butanoate CAS Name: 4-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)butanoate IUPAC Name: 4-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)butanoate Traditional Name: 4-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)butyrate Formula: C12H13N2O3S- MolecularWeight: 265.30822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCCC(=O)[O-])C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCCC(=O)[O-])C

InChI

InChI=1S/C12H14N2O3S/c1-7-8(2)18-11-10(7)12(17)14(6-13-11)5-3-4-9(15)16/h6H,3-5H2,1-2H3,(H,15,16)/p-1