phenethyl 5-methyl-4-oxidanylidene-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: phenethyl 5-methyl-4-oxidanylidene-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 2-benzyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester IUPAC Name: phenethyl 2-benzyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-benzyl-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester Formula: C23H20N2O3S MolecularWeight: 404.4815

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CC3=CC=CC=C3)C(=O)OCCC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CC3=CC=CC=C3)C(=O)OCCC4=CC=CC=C4

InChI

InChI=1S/C23H20N2O3S/c1-15-19-21(26)24-18(14-17-10-6-3-7-11-17)25-22(19)29-20(15)23(27)28-13-12-16-8-4-2-5-9-16/h2-11H,12-14H2,1H3,(H,24,25,26)