ethyl 3-[(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)methyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)methyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[(6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)methyl]benzofuran-2-carboxylate CAS Name: 3-[(6-ethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)methyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[(6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl)methyl]coumarilic acid ethyl ester Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)CC3=C(OC4=CC=CC=C43)C(=O)OCC

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)CC3=C(OC4=CC=CC=C43)C(=O)OCC

InChI

InChI=1S/C20H18N2O4S/c1-3-12-9-14-18(27-12)21-11-22(19(14)23)10-15-13-7-5-6-8-16(13)26-17(15)20(24)25-4-2/h5-9,11H,3-4,10H2,1-2H3