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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O3S/c1-6-7(2)18-12-10(6)11(17)13-8(14-12)4-3-5-9(15)16/h3-5H2,1-2H3,(H,15,16)(H,13,14,17)/p-1