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

Systemtic Name: [2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl] 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: [2-(2-furylmethylcarbamoylamino)-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-[[(2-furanylmethylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylcarbamoylamino)-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-(2-furfurylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H16N4O6S MolecularWeight: 404.39714

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=O)NC(=O)COC(=O)CCN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

C1=COC(=C1)CNC(=O)NC(=O)COC(=O)CCN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C17H16N4O6S/c22-13(20-17(25)18-8-11-2-1-6-26-11)9-27-14(23)3-5-21-10-19-15-12(16(21)24)4-7-28-15/h1-2,4,6-7,10H,3,5,8-9H2,(H2,18,20,22,25)