(2R)-2-[5-(4-ethylphenyl)-4-oxidanylidene-2-propyl-thieno[2,3-d]pyrimidin-3-yl]propanoate

Systemtic Name: (2R)-2-[5-(4-ethylphenyl)-4-oxidanylidene-2-propyl-thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: (2R)-2-[5-(4-ethylphenyl)-4-oxo-2-propyl-thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: (2R)-2-[5-(4-ethylphenyl)-4-oxo-2-propyl-3-thieno[2,3-d]pyrimidinyl]propanoate IUPAC Name: (2R)-2-[5-(4-ethylphenyl)-4-oxo-2-propylthieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: (2R)-2-[5-(4-ethylphenyl)-4-keto-2-propyl-thieno[2,3-d]pyrimidin-3-yl]propionate Formula: C20H21N2O3S- MolecularWeight: 369.45734

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C(=CS2)C3=CC=C(C=C3)CC)C(=O)N1C(C)C(=O)[O-]

Isomeric SMILES

CCCC1=NC2=C(C(=CS2)C3=CC=C(C=C3)CC)C(=O)N1[C@H](C)C(=O)[O-]

InChI

InChI=1S/C20H22N2O3S/c1-4-6-16-21-18-17(19(23)22(16)12(3)20(24)25)15(11-26-18)14-9-7-13(5-2)8-10-14/h7-12H,4-6H2,1-3H3,(H,24,25)/p-1/t12-/m1/s1