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

Systemtic Name: [2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanoate Openeye Name: [2-(2-furylmethylamino)-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)-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylamino)-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-furfurylamino)-2-keto-ethyl] ester Formula: C16H15N3O5S MolecularWeight: 361.3724

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O5S/c20-13(17-8-11-2-1-6-23-11)9-24-14(21)3-5-19-10-18-15-12(16(19)22)4-7-25-15/h1-2,4,6-7,10H,3,5,8-9H2,(H,17,20)