(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl anthracene-9-carboxylate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl anthracene-9-carboxylate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C22H14N2O3S MolecularWeight: 386.42316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C(=O)OCC4=NC(=O)C5=C(N4)C=CS5

Isomeric SMILES

C1=CC=C2C(=C1)C=C3C=CC=CC3=C2C(=O)OCC4=NC(=O)C5=C(N4)C=CS5

InChI

InChI=1S/C22H14N2O3S/c25-21-20-17(9-10-28-20)23-18(24-21)12-27-22(26)19-15-7-3-1-5-13(15)11-14-6-2-4-8-16(14)19/h1-11H,12H2,(H,23,24,25)