3-[5-(furan-2-yl)-4-oxidanylidene-2-(phenylmethyl)thieno[2,3-d]pyrimidin-3-yl]propanoate

Systemtic Name: 3-[5-(furan-2-yl)-4-oxidanylidene-2-(phenylmethyl)thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: 3-[2-benzyl-5-(2-furyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 3-[5-(2-furanyl)-4-oxo-2-(phenylmethyl)-3-thieno[2,3-d]pyrimidinyl]propanoate IUPAC Name: 3-[2-benzyl-5-(furan-2-yl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: 3-[2-benzyl-5-(2-furyl)-4-keto-thieno[2,3-d]pyrimidin-3-yl]propionate Formula: C20H15N2O4S- MolecularWeight: 379.4091

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC3=C(C(=CS3)C4=CC=CO4)C(=O)N2CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC3=C(C(=CS3)C4=CC=CO4)C(=O)N2CCC(=O)[O-]

InChI

InChI=1S/C20H16N2O4S/c23-17(24)8-9-22-16(11-13-5-2-1-3-6-13)21-19-18(20(22)25)14(12-27-19)15-7-4-10-26-15/h1-7,10,12H,8-9,11H2,(H,23,24)/p-1