[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-ethyl] 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate CAS Name: 3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanoic acid [2-(methylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxoethyl] 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanoate Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propionic acid [2-keto-2-(methylcarbamoylamino)ethyl] ester Formula: C13H14N4O5S MolecularWeight: 338.33906

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)COC(=O)CCN1C=NC2=C(C1=O)C=CS2

Isomeric SMILES

CNC(=O)NC(=O)COC(=O)CCN1C=NC2=C(C1=O)C=CS2

InChI

InChI=1S/C13H14N4O5S/c1-14-13(21)16-9(18)6-22-10(19)2-4-17-7-15-11-8(12(17)20)3-5-23-11/h3,5,7H,2,4,6H2,1H3,(H2,14,16,18,21)