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

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-methyl-1-benzofuran-2-carboxylate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl 3-methylbenzofuran-2-carboxylate CAS Name: 3-methyl-2-benzofurancarboxylic 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 3-methyl-1-benzofuran-2-carboxylate Traditional Name: 3-methylcoumarilic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C17H12N2O4S MolecularWeight: 340.35318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C17H12N2O4S/c1-9-10-4-2-3-5-12(10)23-14(9)17(21)22-8-13-18-11-6-7-24-15(11)16(20)19-13/h2-7H,8H2,1H3,(H,18,19,20)