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

Systemtic Name: phenethyl 5-methyl-4-oxidanylidene-3-(2-oxidanylidene-2-thiophen-2-yl-ethyl)thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 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 phenethyl ester IUPAC Name: phenethyl 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 phenethyl ester Formula: C22H18N2O4S2 MolecularWeight: 438.51932

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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)OCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)C3=CC=CS3)C(=O)OCCC4=CC=CC=C4

InChI

InChI=1S/C22H18N2O4S2/c1-14-18-20(23-13-24(21(18)26)12-16(25)17-8-5-11-29-17)30-19(14)22(27)28-10-9-15-6-3-2-4-7-15/h2-8,11,13H,9-10,12H2,1H3