(phenylmethyl) 5-methyl-4-oxidanylidene-3-(2-oxidanylidene-2-thiophen-2-yl-ethyl)thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: (phenylmethyl) 5-methyl-4-oxidanylidene-3-(2-oxidanylidene-2-thiophen-2-yl-ethyl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: benzyl 5-methyl-4-oxo-3-[2-oxo-2-(2-thienyl)ethyl]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-(2-oxo-2-thiophen-2-ylethyl)-6-thieno[2,3-d]pyrimidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-methyl-4-oxo-3-(2-oxo-2-thiophen-2-ylethyl)thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-3-[2-keto-2-(2-thienyl)ethyl]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid benzyl ester Formula: C21H16N2O4S2 MolecularWeight: 424.49274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)C3=CC=CS3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)C3=CC=CS3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C21H16N2O4S2/c1-13-17-19(29-18(13)21(26)27-11-14-6-3-2-4-7-14)22-12-23(20(17)25)10-15(24)16-8-5-9-28-16/h2-9,12H,10-11H2,1H3