3-(2,6-diethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: 3-(2,6-diethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: 3-(2,6-diethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(2,6-diethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoate IUPAC Name: 3-(2,6-diethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-(2,6-diethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl)propionate Formula: C13H15N2O3S- MolecularWeight: 279.3348

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CCC(=O)[O-])CC

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CCC(=O)[O-])CC

InChI

InChI=1S/C13H16N2O3S/c1-3-8-7-9-12(19-8)14-10(4-2)15(13(9)18)6-5-11(16)17/h7H,3-6H2,1-2H3,(H,16,17)/p-1