ethyl 5-(3-methylbutyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-2-carboxylate

Systemtic Name: ethyl 5-(3-methylbutyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-2-carboxylate Openeye Name: ethyl 5-isopentyl-4-oxo-3H-thieno[2,3-d]pyrimidine-2-carboxylate CAS Name: 5-(3-methylbutyl)-4-oxo-3H-thieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(3-methylbutyl)-4-oxo-3H-thieno[2,3-d]pyrimidine-2-carboxylate Traditional Name: 5-isoamyl-4-keto-3H-thieno[2,3-d]pyrimidine-2-carboxylic acid ethyl ester Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=C(C(=CS2)CCC(C)C)C(=O)N1

Isomeric SMILES

CCOC(=O)C1=NC2=C(C(=CS2)CCC(C)C)C(=O)N1

InChI

InChI=1S/C14H18N2O3S/c1-4-19-14(18)11-15-12(17)10-9(6-5-8(2)3)7-20-13(10)16-11/h7-8H,4-6H2,1-3H3,(H,15,16,17)