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

Systemtic Name: butan-2-yl 2-[5-(4-ethoxyphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]propanoate Openeye Name: sec-butyl 2-[5-(4-ethoxyphenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]propanoate CAS Name: 2-[5-(4-ethoxyphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]propanoic acid butan-2-yl ester IUPAC Name: butan-2-yl 2-[5-(4-ethoxyphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]propanoate Traditional Name: 2-(4-keto-5-p-phenetyl-thieno[2,3-d]pyrimidin-3-yl)propionic acid sec-butyl ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C(C)N1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)OCC

Isomeric SMILES

CCC(C)OC(=O)C(C)N1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)OCC

InChI

InChI=1S/C21H24N2O4S/c1-5-13(3)27-21(25)14(4)23-12-22-19-18(20(23)24)17(11-28-19)15-7-9-16(10-8-15)26-6-2/h7-14H,5-6H2,1-4H3