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

Systemtic Name: 2-methylpropyl 5-methyl-4-oxidanylidene-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isobutyl 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 2-methylpropyl ester IUPAC Name: 2-methylpropyl 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 isobutyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O3S/c1-11(2)10-24-19(23)16-12(3)15-17(22)20-14(21-18(15)25-16)9-13-7-5-4-6-8-13/h4-8,11H,9-10H2,1-3H3,(H,20,21,22)